Cyproterone acetate

CAS Number: 427-51-0

Molecular Mass: 416.9 g/mol

Formula: C₂₄H₂₉ClO₄

Smiles: CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@@]21C

Synonymes:

Cyproterone acetate, CYPROTERONE ACETATE, 427-51-0, Androcur, Cyproterone 17-O-acetate, Cyprostat, NSC-81430, SH 714, SH-714, Cyproterone 17alpha-acetate, DTXSID5020366, 4KM2BN5JHF, SH714, NSC81430, 3'H-Cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1beta,2beta)-, DTXCID30366, CHEBI:50743, (1R,3aS,3bR,7aR,8aS,8bS,8cS,10aS)-1-acetyl-5-chloro-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,7,7a,8,8a,8b,8c,9,10,10a-tetradecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl acetate, 6-chloro-3,20-dioxo-1beta,2beta-dihydro-3'H-cyclopropa[1,2]pregna-4,6-dien-17-yl acetate, Cyprone, Dianette, Cyproteronazetat, CyPat, Andro-Diane, 6-chloro-3,20-dioxo-1beta,2beta-dihydro-3'H-cyclopropa(1,2)pregna-4,6-dien-17-yl acetate, Cyproteroni Acetas, Androcur 10, (1R,3aS,3bR,7aR,8aS,8bS,8cS,10aS)-1-acetyl-5-chloro-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,7,7a,8,8a,8b,8c,9,10,10a-tetradecahydrocyclopenta(a)cyclopropa(g)phenanthren-1-yl acetate, 3'H-Cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1beta,2beta)-, RefChem:581390, 1,2alpha-Methylene-6-chloro-17alpha-acetoxy-4,6-pregnadiene-3,20-dione, 1,2alpha-Methylene-6-chloro-pregna-4,6-diene-3,20-dione 17alpha-acetate, Chloro-6-hydroxy-17 Alpha Methylene-1 Alpha, 2 Alpha Pregnadiene-4,6 Dione-3, 20 Acetate, (1S,2S,3S,5R,11R,12S,15R,16S)-15-acetyl-9-chloro-2,16-dimethyl-6-oxopentacyclo(9.7.0.02,8.03,5.012,16)octadeca-7,9-dien-15-yl acetate, 207-048-3, 6-Chloro-1b,2b-dihydro-17a-hydroxy-3'H-cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione Acetate, Diane, Cyproteroneacetate, Cyproteron acetate, Cyproteron-R acetate, MFCD00864671, SH 80714, Cyprosterone acetate, Cyproterone 17.alpha.-acetate, C24H29ClO4, MLS000859908, CHEMBL139835, 6-Chloro-1beta,2beta-dihydro-17-hydroxy-3'H-cyclopropa(1,2)-pregna-1,4,6-triene-3,20-dione acetate, NCGC00091032-03, 3'H-Cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1.beta.,2.beta.)-, Cyproterone (acetate), (1S,2S,3S,12S,16S,5R,11R,15R)-15-acetyl-9-chloro-2,16-dimethyl-6-oxopentacyclo [9.7.0.0<2,8>.0<3,5>.0<12,16>]octadeca-7,9-dien-15-yl acetate, (2aR,3aS,3bS,3cS,5aS,6R,8aS,8bR)-6-acetyl-10-chloro-3b,5a-dimethyl-2-oxo-2,2a,3,3a,3b,3c,4,5,5a,6,7,8,8a,8b-tetradecahydrocyclopenta[a]cyclopropa[g]phenanthren-6-yl acetate, [(1S,2S,3S,5R,11R,12S,15R,16S)-15-acetyl-9-chloro-2,16-dimethyl-6-oxo-15-pentacyclo[9.7.0.02,8.03,5.012,16]octadeca-7,9-dienyl] acetate, SMR000326769, CCRIS 4385, HSDB 3592, SR-01000075755, EINECS 207-048-3, UNII-4KM2BN5JHF, NSC 81430, Cyprostat&reg, cyproterone-acetate, CAS-427-51-0, 2oz7, Cyproterone acetate CRS, 6-Chloro-delta-6-1,2alpha-methylene-17alpha-hydroxyprogesterone acetate, 1,2-alpha-Methylene-6-chloro-delta(sup 6)-17-alpha-hydroxyprogesterone acetate, 1,2-alpha-Methylene-6-chloro-pregna-4,6-diene-3,20-dione 17-alpha-acetate, 6-Chloro-1,2-alpha-methylene-6-dehydro-17-alpha-hydroxyprogesterone acetate, 6-Chloro-delta(sup 6)-1,2-alpha-methylene-17-alpha-hydroxyprogesterone acetate, cid_9880, SCHEMBL5936, 1,2-alpha-Methylene-6-chloro-(sup 4,6)-pregnadiene-17-alpha-ol-3,20-dione 17-alpha-acetate, 17-alpha-Acetoxy-6-chloro-1-alpha,2-alpha-methylenepregna-4,6-diene-3,20-dione, 6-Chlor-delta(sup 6)-1,2-alpha-methylen-17-alpha-hydroxyprogesteronacetat [German], 6-Chloro-1,2-alpha-methylene-17-alpha-hydroxy-delta(sup 6)-progesterone acetate, 6-Chloro-17-hydroxy-1-alpha,2-alpha-methylenepregna-4,6-diene-3,20-dione acetate, Pregna-4,6-diene-3,20-dione, 6-chloro-17-hydroxy-1-alpha,2-alpha-methylene-, acetate, BIDD:PXR0052, Lopac0_000301, MLS001055462, MLS001066353, MLS002207305, MLS006011110, Cyproterone acetate, >=98%, GTPL2865, orb1309541, CYPROTERONE ACETATE [MI], CYPROTERONE ACETATE [JAN], MSK8587, CYPROTERONE ACETATE [HSDB], CYPROTERONE ACETATE [USAN], HMS2090A14, HMS2233J06, HMS3260N04, CYPROTERONE ACETATE [MART.], Tox21_111064, Tox21_201686, Tox21_302941, Tox21_500301, AC-929, BDBM50094569, CYPROTERONE ACETATE [WHO-DD], DL-368, EBC-17100, MSK8587-100A, MSK8587-100M, s2042, 6-Chlor-delta(sup 6)-1,2-alpha-methylen-17-alpha-hydroxyprogesteronacetat, AKOS008901350, AKOS015895238, Tox21_111064_1, CCG-204396, DB04839, FC20764, LP00301, SDCCGSBI-0050289.P002, NCGC00091032-01, NCGC00091032-04, NCGC00091032-05, NCGC00091032-09, NCGC00091032-12, NCGC00256442-01, NCGC00259235-01, NCGC00260986-01, NCGC00262575-02, Progesterone,2.alpha.-methylene, acetate, 3'H-Cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione, 6-chloro-1-beta,2-beta-dihydro-17-hydroxy-, acetate, 6-Chloro-1-beta,2-beta-dihydro-17-hydroxy-3'H-cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione 17-acetate, CYPROTERONE ACETATE [EP MONOGRAPH], SMR000686068, ST075180, SY075617, Progesterone,2.alpha.-methylene-, acetate, (acetyl-chloro-dimethyl-oxo-[?]yl) acetate, 1,6-diene-3,20-dione 17.alpha.-acetate, C2942, EU-0100301, NS00003744, C 3412, Cyproterone acetate for peak identification CRS, D01368, AB00698312-08, 1,6)-pregnadeine-17.alpha.-3,20-dione acetate, EN300-19765943, Q426185, Cyproterone acetate Solution in Methanol, 100ug/mL, SR-01000075755-1, SR-01000075755-4, SR-01000075755-6, 1,6)-pregnadiene-17.alpha.-ol-3,20-dione acetate, BRD-K41141507-001-15-4, BRD-K41141507-001-16-2, Cyproterone acetate Solution in Acetonitrile, 100ug/mL, WLN: L F3 E6 D665 IV JU LUTJ A1 E1 RV1 RQ, 17.alpha.-Acetoxy-6-chloro-1.alpha.,6-diene-3,20-dione, 6-Chloro-17-hydroxy-1.alpha.,6-diene-3,20-dione acetate, 1,6)-pregnadiene-17.alpha.-ol-3,20-dione 17alpha-acetate, 6-Chloro-1.beta.,2]pregna-1,4,6-triene-3,20-dione acetate, Cyproterone acetate, European Pharmacopoeia (EP) Reference Standard, 6-chloro-17-acetoxy-1alpha,2alpha-methylene-4,6-pregnadiene-3,20-dione, 1,2.alpha.-Methylene-6-chloro-.delta.(sup 6)-17.alpha.-hydroxyprogesterone acetate, 17alpha-acetoxy-6-chloro-1alpha,2alpha-methylene-4,6-pregnadiene-3,20-dione, 6-Chloro-.delta.(sup 6)-1,2.alpha.-methylene-17.alpha.-hydroxyprogesterone acetate, 6-Chloro-1,2.alpha.-methylene-17.alpha.-hydroxy-.delta.(sup 6)-progesterone acetate, 6-Chloro-1,2.alpha.-methylene-6-dehydro-17.alpha.-hydroxyprogesterone acetate, 6-Chloro-17-hydroxy-1alpha,2alpha-methylenepregna-4,6-diene-3,20-dione acetate, Cyproterone acetate for peak identification, European Pharmacopoeia (EP) Reference Standard, Pregna-4,20-dione, 6-chloro-17-hydroxy-1.alpha.,2.alpha.-methylene-, acetate, (1beta,2beta)-17-(Acetyloxy)-6-chloro-1,2-dihydro-3'H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, (1S,2S,3S,5R,11R,12S,15R,16S)-15-acetyl-9-chloro-2,16-dimethyl-6-oxopentacyclo[9.7.0.0^{2,8}.0^{3,5}.0^{12,16}]octadeca-7,9-dien-15-yl acetate, 3'H-Cyclopropa[1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1.beta.,2.beta.)-, 3'H-Cyclopropa[1,4,6-triene-3,20-dione, 6-chloro-1.beta.,2.beta.-dihydro-17-hydroxy-, acetate, 3'H-Cyclopropa[1,4,6-triene-3,20-dione, 6-chloro-1.beta.,2.beta.-dihydro-17-hydroxy-,acetate, 6-Chloro-1?,2?-dihydro-17-hydroxy-3'H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione 17-acetate, 6-chloro-3,20-dioxo-1beta,2beta-dihydro-3''H-cyclopropa[1,2]pregna-4,6-dien-17-yl acetate, 6-Chloro-3,20-dioxo-1beta,2beta-dihydro-3'H-cyclopropa[1,2]pregna-1,4,6-trien-17-yl acetate, acetic acid (8R,9S,10S,13S,14S,17R)-17-acetyl-6-(S)-chloro-10,13-dimethyl-3-(R)-oxo-1,2,3,8,9,10,11,12,13,14,15,16,17,20-tetradecahydro-cyclopropa[1,2]cyclopenta[a]phenanthren-17-yl ester

Bioactivity: -

Solubility in Different Solvents

Solvent	Temperature [K]	Crystal form	Solubility [mg/mL]	Reference
1-Butanol	273.15	-	1.954	[327]
1-Butanol	278.15	-	1.951	[327]
1-Butanol	283.15	-	1.947	[327]
1-Butanol	288.15	-	1.941	[327]
1-Butanol	293.15	-	1.936	[327]
1-Butanol	298.15	-	1.93	[327]
1-Butanol	303.15	-	1.924	[327]
1-Butanol	308.15	-	1.917	[327]
1-Butanol	313.15	-	1.909	[327]
1-Butanol	318.15	-	1.902	[327]
Acetone	273.15	-	2.476	[327]
Acetone	278.15	-	2.461	[327]
Acetone	283.15	-	2.446	[327]
Acetone	288.15	-	2.43	[327]
Acetone	293.15	-	2.412	[327]
Acetone	298.15	-	2.397	[327]
Acetone	303.15	-	2.38	[327]
Acetone	308.15	-	2.364	[327]
Acetone	313.15	-	2.346	[327]
Acetone	318.15	-	2.327	[327]
Acetonitrile	273.15	-	1.942	[327]
Acetonitrile	278.15	-	1.931	[327]
Acetonitrile	283.15	-	1.92	[327]
Acetonitrile	288.15	-	1.908	[327]
Acetonitrile	293.15	-	1.896	[327]
Acetonitrile	298.15	-	1.884	[327]
Acetonitrile	303.15	-	1.873	[327]
Acetonitrile	308.15	-	1.861	[327]
Acetonitrile	313.15	-	1.849	[327]
Acetonitrile	318.15	-	1.837	[327]
Chloroform	273.15	-	2.464	[327]
Chloroform	278.15	-	2.45	[327]
Chloroform	283.15	-	2.434	[327]
Chloroform	288.15	-	2.419	[327]
Chloroform	293.15	-	2.404	[327]
Chloroform	298.15	-	2.389	[327]
Chloroform	303.15	-	2.373	[327]
Chloroform	308.15	-	2.358	[327]
Chloroform	313.15	-	2.342	[327]
Chloroform	318.15	-	2.326	[327]
Dimethylformamide	273.15	-	2.424	[327]
Dimethylformamide	278.15	-	2.418	[327]
Dimethylformamide	283.15	-	2.411	[327]
Dimethylformamide	288.15	-	2.402	[327]
Dimethylformamide	293.15	-	2.392	[327]
Dimethylformamide	298.15	-	2.383	[327]
Dimethylformamide	303.15	-	2.371	[327]
Dimethylformamide	308.15	-	2.361	[327]
Dimethylformamide	313.15	-	2.349	[327]
Dimethylformamide	318.15	-	2.337	[327]
Ethanol	273.15	-	2.398	[327]
Ethanol	278.15	-	2.395	[327]
Ethanol	283.15	-	2.386	[327]
Ethanol	288.15	-	2.379	[327]
Ethanol	293.15	-	2.373	[327]
Ethanol	298.15	-	2.365	[327]
Ethanol	303.15	-	2.354	[327]
Ethanol	308.15	-	2.341	[327]
Ethanol	313.15	-	2.33	[327]
Ethanol	318.15	-	2.318	[327]
Ethyl acetate	273.15	-	2.45	[327]
Ethyl acetate	278.15	-	2.432	[327]
Ethyl acetate	283.15	-	2.418	[327]
Ethyl acetate	288.15	-	2.401	[327]
Ethyl acetate	293.15	-	2.386	[327]
Ethyl acetate	298.15	-	2.37	[327]
Ethyl acetate	303.15	-	2.354	[327]
Ethyl acetate	308.15	-	2.338	[327]
Ethyl acetate	313.15	-	2.322	[327]
Ethyl acetate	318.15	-	2.305	[327]
Isopropanol	273.15	-	2.402	[327]
Isopropanol	278.15	-	2.393	[327]
Isopropanol	283.15	-	2.383	[327]
Isopropanol	288.15	-	2.374	[327]
Isopropanol	293.15	-	2.365	[327]
Isopropanol	298.15	-	2.355	[327]
Isopropanol	303.15	-	2.347	[327]
Isopropanol	308.15	-	2.339	[327]
Isopropanol	313.15	-	2.33	[327]
Isopropanol	318.15	-	2.321	[327]
Methanol	273.15	-	2.409	[327]
Methanol	278.15	-	2.399	[327]
Methanol	283.15	-	2.389	[327]
Methanol	288.15	-	2.377	[327]
Methanol	293.15	-	2.366	[327]
Methanol	298.15	-	2.354	[327]
Methanol	303.15	-	2.342	[327]
Methanol	308.15	-	2.329	[327]
Methanol	313.15	-	2.316	[327]
Methanol	318.15	-	2.302	[327]
Tetrahydrofuran	273.15	-	2.458	[327]
Tetrahydrofuran	278.15	-	2.444	[327]
Tetrahydrofuran	283.15	-	2.429	[327]
Tetrahydrofuran	288.15	-	2.414	[327]
Tetrahydrofuran	293.15	-	2.398	[327]
Tetrahydrofuran	298.15	-	2.384	[327]
Tetrahydrofuran	303.15	-	2.369	[327]
Tetrahydrofuran	308.15	-	2.354	[327]
Tetrahydrofuran	313.15	-	2.339	[327]
Tetrahydrofuran	318.15	-	2.324	[327]
Water	273.15	-	0.0153	[327]
Water	278.15	-	0.0201	[327]
Water	283.15	-	0.0269	[327]
Water	288.15	-	0.036	[327]
Water	293.15	-	0.0484	[327]
Water	298.15	-	0.0644	[327]
Water	303.15	-	0.0847	[327]
Water	308.15	-	0.1122	[327]
Water	313.15	-	0.1461	[327]
Water	318.15	-	0.1882	[327]
tert-Butyl methyl ether	273.15	-	2.433	[327]
tert-Butyl methyl ether	278.15	-	2.417	[327]
tert-Butyl methyl ether	283.15	-	2.402	[327]
tert-Butyl methyl ether	288.15	-	2.39	[327]
tert-Butyl methyl ether	293.15	-	2.376	[327]
tert-Butyl methyl ether	298.15	-	2.361	[327]
tert-Butyl methyl ether	303.15	-	2.342	[327]
tert-Butyl methyl ether	308.15	-	2.327	[327]
tert-Butyl methyl ether	313.15	-	2.312	[327]
tert-Butyl methyl ether	318.15	-	2.298	[327]

Molecule 3D descriptors

Descriptor	Value
PMI1	1695.8404
PMI2	5588.8817
PMI3	6075.0853
NPR1	0.2791
NPR2	0.9200
RadiusOfGyration	4.0026
InertialShapeFactor	0.0005
Eccentricity	0.9602
Asphericity	0.3874
SpherocityIndex	0.3886
PBF	1.2485