β tegafur

CAS Number: 17902-23-7

Molecular Mass: 200.17 g/mol

Formula: C₈H₉FN₂O₃

Smiles: O=c1[nH]c(=O)n(C2CCCO2)cc1F

Synonymes:

β tegafur, tegafur, 17902-23-7, Ftorafur, Futraful, Sinoflurol, Fental, Neberk, Citofur, Lamar, Lifril, Coparogin, Furafluor, Furofutran, Nitobanil, Exonal, Fulfeel, Tefsiel C, Riol, Florafur, FT-207, Franrose, Sunfural, Fulaid, MJF-12264, Atillon, Tegafurum, 1-(2-Tetrahydrofuryl)-5-fluorouracil, NSC-148958, 5-fluoro-1-(oxolan-2-yl)pyrimidine-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)-, URACIL, 5-FLUORO-1-(TETRAHYDRO-2-FURYL)-, 5-Fluoro-1-(tetrahydro-2-furanyl)-2,4-pyrimidinedione, 5-fluoro-1-tetrahydrofuran-2-yl-pyrimidine-2,4-dione, 1548R74NSZ, FT207, TS-1 component tegafur, FT 207, N1-(2'-Tetrahydrofuryl)-5-fluorouracil, TEYSUNO COMPONENT TEGAFUR, DTXSID001009966, N1-(2'-Furanidyl)-5-fluorouracil, 5-fluoro-1-(tetrahydro-2-furyl)-uracil, 5-Fluoro-1-(tetrahydro-2-furanyl)-2,4(1H,3H)-pyrimidinedione, J356.722B, Tefsiel, NSC148958, Ftoralon, Ftoral, Utefos, 1-(Tetrahydro-2-furanyl)-5-fluorouracil, RefChem:891301, DTXCID701305, L01BC03, WR-220066, 5-Fluoro-1-((2RS)-tetrahydrofuran-2-yl)uracil, 5-Fluoro-1-(tetrahydro-2-furanyl)-2,4-(1H,3H)-pyrimidinedione, BMS-200604, Fluorofur, 5-fluoro-1-(tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione, 5-Fluoro-1-(tetrahydro-2-furyl)uracil, Franroze, Furflucil, Sunfral, Phthorafur, 5-FLUORO-1-(TETRAHYDRO-2-FURFURYL)URACIL, C8H9FN2O3, MFCD00012351, 1-(Tetrahydrofuran-2-yl)-5-fluorouracil, 5-Fluoro-1-(tetrahydrofuran-2-yl)uracil, N1-(2-tetrahydrofuryl)-5-fluorouracil, FT-207 (NSC 148958), Uracil, 1-(tetrahydrofuran-2-yl)-5-fluoro-, 79107-97-4, 5-fluoro-1-(oxolan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione, 5-Fluoro-1-(tetrahydro-3-furyl)uracil, 1-(Tetrahydro-2-furanyl)-5-fluoro-2,4-pyrimidinedione, MLS000069497, Fluorafur, SMR000059106, 2,4(1H,3H)Pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)-, Racemic Ftorafur, 82294-77-7, Phthorafur [Czech], Tegafurum [INN-Latin], NSC 148958, CCRIS 2762, EINECS 241-846-2, BRN 0525766, Tegafuris, UNII-1548R74NSZ, Furflucil, , Ftorafur, , Futraful, , Citofur, , Tegafur?, Neberk, , N(sub 1)-(2-Tetrahydrofuryl)-5-fluorouracil, Tegafur [USAN:INN:BAN:JAN], 1-(2-TETRAHYDROFORMYL)-5-FLUOROURACIL, N(sub 1)-(2'-Furanidyl)-5-fluouracil [Czech], NCGC00159418-02, NCGC00159418-05, Atillon (TN), Tegafur (Standard), S-1 component tegafur, N(sub 1)-(2'-Furanidyl)-5-fluouracil, TS-1 (Salt/Mix), TEGAFUR [USAN], TEGAFUR [INN], TEGAFUR [JAN], TEGAFUR [MI], Opera_ID_1726, TEGAFUR [MART.], TEGAFUR [WHO-DD], UPCMLD-DP063, SCHEMBL4552, TEGAFUR [EMA EPAR], 5-24-06-00285 (Beilstein Handbook Reference), MLS000759414, MLS001076521, MLS001424119, CHEMBL20883, Tegafur (JP18/USAN/INN), F-5-FU, orb1308791, orb3141400, SCHEMBL27802890, UPCMLD-DP063:001, CHEBI:32188, GTPL10513, GLXC-07064, HMS1665I05, HMS2051B15, HMS2090K04, HMS2232E05, HMS3371H21, HMS3393B15, HMS3654P13, HMS3715D14, HMS5079B09, N1-(2'-Furanidyl)-5-fluouracil, BBL027795, CCG-50110, EBC-03486, HY-17400R, STK528044, Tegafur, >=98% (HPLC), powder, 5-Fluoro-1-(2-tetrahydrofuryl)uracil, AKOS000121279, AC-2112, CCG-100959, CS-1128, DB09256, FF08013, NC00209, 1-(tetrahydro-2-furyl)-5-fluorouracil, 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)-, didehydroderiv., 5-fluoro-1-(2-tetrahydrofuranyl)uracil, N1 -(2-tetrahydrofuryl)-5-fluorouracil, NCGC00159418-04, AS-13528, BP-58663, HY-17400, SY057932, Tegafur (FT-207, NSC 148958), NS00007105, EN300-21668, D01244, AB00572620-15, F815549, Q413370, SR-01000639511, SR-01000639511-1, SR-01000639511-4, 5-Fluoro-1-(oxolan-2-yl)pyrimidine-2,4(1H,3H)-dione, Z104508106, 5-fluoro-1-tetrahydro-furan-2-yl-1H-pyrimidine-2,4-dione, pyrimidine-2,4(1H,3H)-dione, 5-fluoro-1-(2-oxolanyl)-, 5-Fluoro-1-tetrahydro-2-furanyl-2,4(1H,3H)-pyrimidinedione, 2, 4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)-, (R)-

Bioactivity: -

Solubility in Different Solvents

Solvent	Temperature [K]	Crystal form	Solubility [mg/mL]	Reference
1-Propanol	273.15	-	3.06	[117]
1-Propanol	278.15	-	3.846	[117]
1-Propanol	283.15	-	4.757	[117]
1-Propanol	288.15	-	6.006	[117]
1-Propanol	293.15	-	7.343	[117]
1-Propanol	298.15	-	9.156	[117]
1-Propanol	303.15	-	11.17	[117]
1-Propanol	308.15	-	13.67	[117]
1-Propanol	313.15	-	16.31	[117]
Acetone	273.15	-	26.37	[117]
Acetone	278.15	-	32.47	[117]
Acetone	283.15	-	39.14	[117]
Acetone	288.15	-	46.8	[117]
Acetone	293.15	-	54.44	[117]
Acetone	298.15	-	64.55	[117]
Acetone	303.15	-	76.36	[117]
Acetone	308.15	-	89.78	[117]
Acetone	313.15	-	106.6	[117]
Ethanol	273.15	-	4.153	[117]
Ethanol	278.15	-	5.312	[117]
Ethanol	283.15	-	6.886	[117]
Ethanol	288.15	-	8.753	[117]
Ethanol	293.15	-	10.94	[117]
Ethanol	298.15	-	13.78	[117]
Ethanol	303.15	-	17.26	[117]
Ethanol	308.15	-	21.35	[117]
Ethanol	313.15	-	25.93	[117]
Ethyl acetate	273.15	-	12.83	[117]
Ethyl acetate	278.15	-	15.1	[117]
Ethyl acetate	283.15	-	17.5	[117]
Ethyl acetate	288.15	-	19.9	[117]
Ethyl acetate	293.15	-	22.46	[117]
Ethyl acetate	298.15	-	25.12	[117]
Ethyl acetate	303.15	-	27.98	[117]
Ethyl acetate	308.15	-	31.24	[117]
Ethyl acetate	313.15	-	35.41	[117]
Isopropanol	273.15	-	2.3	[117]
Isopropanol	278.15	-	2.895	[117]
Isopropanol	283.15	-	3.672	[117]
Isopropanol	288.15	-	4.716	[117]
Isopropanol	293.15	-	5.943	[117]
Isopropanol	298.15	-	7.473	[117]
Isopropanol	303.15	-	9.296	[117]
Isopropanol	308.15	-	11.48	[117]
Isopropanol	313.15	-	14.07	[117]
Methanol	273.15	-	18.38	[117]
Methanol	278.15	-	21.62	[117]
Methanol	283.15	-	24.89	[117]
Methanol	288.15	-	29.63	[117]
Methanol	293.15	-	34.44	[117]
Methanol	298.15	-	39.73	[117]
Methanol	303.15	-	45.58	[117]
Methanol	308.15	-	52.27	[117]
Methanol	313.15	-	61.31	[117]

Molecule 3D descriptors

Descriptor	Value
PMI1	312.1943
PMI2	1180.4412
PMI3	1370.4876
NPR1	0.2278
NPR2	0.8613
RadiusOfGyration	2.6743
InertialShapeFactor	0.0028
Eccentricity	0.9737
Asphericity	0.4660
SpherocityIndex	0.2496
PBF	0.5392