Tinidazole

CAS Number: 19387-91-8

Molecular Mass: 247.27 g/mol

Formula: C₈H₁₃N₃O₄S

Smiles: CCS(=O)(=O)CCn1c([N+](=O)[O-])cnc1C

Synonymes:

Tinidazole, tinidazole, 19387-91-8, Fasigyn, Trimonase, Fasigin, Tricolam, 1-(2-(Ethylsulfonyl)ethyl)-2-methyl-5-nitro-1H-imidazole, Simplotan, Tinidazol, Sorquetan, Haisigyn, Tinidazolum, Pletil, 1-(2-ethylsulfonylethyl)-2-methyl-5-nitroimidazole, CP 12574, timidazole, 1-[2-(Ethylsulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole, 1H-Imidazole, 1-[2-(ethylsulfonyl)ethyl]-2-methyl-5-nitro-, CP-12574, 1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole, CP-12,574, Symplotan, DTXSID4023676, 1-(2-(Ethylsulfonyl)ethyl)-2-methyl-5-nitroimidazole, NSC-758189, 1H-Imidazole, 1-(2-(ethylsulfonyl)ethyl)-2-methyl-5-nitro-, CHEBI:63627, 033KF7V46H, DTXCID003676, 1-[2-(Ethylsulfonyl)ethyl]-2-methyl-5-nitroimidazole, Imidazole, 1-(2-(ethylsulfonyl)ethyl)-2-methyl-5-nitro-, Fasygin, Fasigyne, tinidazolo, 1-(2-(ethanesulfonyl)ethyl)-2-methyl-5-nitro-1H-imidazole, Tindazole, CP12574, CP12,574, RefChem:56131, CP 12,574, J01XD02, P01AB02, 243-014-4, Tindamax, Bioshik, MFCD00057217, MLS000069717, 1-(2-ethylsulfonylethyl)-2-methyl-5-nitro-imidazole, 148159-84-6, NCGC00016741-01, SMR000058194, CAS-19387-91-8, 1-(ethylsulfonyl)-2-(2-methyl-5-nitroimidazolyl)ethane, Glongyn, Amtiba, Tinidazol [INN-Spanish], Tinidazolum [INN-Latin], CCRIS 7621, HSDB 7362, SR-01000000210, EINECS 243-014-4, BRN 0618182, Ethyl (2-(2-methyl-5-nitro-1-imidazolyl)ethyl)sulfone, UNII-033KF7V46H, Simplotan, , Fasigyne, , Tricolam, , Glongyn, , Fasigyntrade mark, Tinidazole CRS, Tindamaxtrade mark, Simplotantrade mark, Haisigyn (TN), Tindamax (TN), Prestwick_136, Tinidazole [USAN:USP:INN:BAN:JAN], Tinidazole (Standard), Spectrum_001266, Opera_ID_779, SpecPlus_000708, TINIDAZOLE [MI], TINIDAZOLE [INN], TINIDAZOLE [JAN], Prestwick0_000766, Prestwick1_000766, Prestwick2_000766, Prestwick3_000766, Spectrum2_000648, Spectrum3_001512, Spectrum4_000230, Spectrum5_001715, TINIDAZOLE [HSDB], TINIDAZOLE [USAN], TINIDAZOLE [VANDF], TINIDAZOLE [MART.], CHEMBL1220, TINIDAZOLE [USP-RS], TINIDAZOLE [WHO-DD], Oprea1_342844, SCHEMBL21141, BSPBio_000812, BSPBio_003183, KBioGR_000899, KBioSS_001746, 5-23-05-00067 (Beilstein Handbook Reference), MLS001146883, MLS001424192, DivK1c_006804, SPECTRUM1502127, SPBio_000655, SPBio_002751, BPBio1_000894, orb1310193, Tinidazole (JP18/USP/INN), TINIDAZOLE [ORANGE BOOK], GTPL12341, HY-B0177R, KBio1_001748, KBio2_001746, KBio2_004314, KBio2_006882, KBio3_002683, MSK5579, TINIDAZOLE [EP MONOGRAPH], GLXC-08144, HMS1570I14, HMS1921L06, HMS2052C09, HMS2090B14, HMS2092D14, HMS2097I14, HMS2231E23, HMS3374P07, HMS3394C09, HMS3652A08, HMS3714I14, HMS5082M06, Pharmakon1600-01502127, TINIDAZOLE [USP MONOGRAPH], HY-B0177, Tox21 110586, Tox21_110586, BBL010767, BDBM50248360, CCG-39907, EBC-08203, NSC758189, s4068, STK801761, AKOS000747070, MSK5579-1000M, Tox21_110586_1, AC-1618, CS-2055, DB00911, FT28285, KS-5180, NC00346, NSC 758189, NCGC00016741-02, NCGC00016741-03, NCGC00016741-04, NCGC00016741-05, NCGC00016741-06, NCGC00016741-07, NCGC00016741-09, NCGC00022212-03, NCGC00022212-04, NCGC00022212-05, ST024770, Tinidazole 100 microg/mL in Acetonitrile, SBI-0052674.P002, AB00053176, NS00010248, SW196447-4, T0893, Tinidazole Solution in Methanol, 1000ug/mL, VU0239922-6, D01426, EN300-119371, Tinidazole, VETRANAL(TM), analytical standard, AB00053176-16, AB00053176_17, AB00053176_18, F241297, Q1321320, SR-01000000210-3, SR-01000000210-5, SR-01000000210-6, 1-[2-Ethylsulfonyl)ethyl]-2-methyl-5-nitroimidazole, BRD-K89125793-001-05-4, BRD-K89125793-001-25-2, BRD-K89125793-001-26-0, BRD-K89125793-001-27-8, Z56763819, 1-(2'-(ethylsulfonyl)-Ethyl]-2-Methyl-5-Nitroimidazole, Tinidazole, European Pharmacopoeia (EP) Reference Standard, Tinidazole, United States Pharmacopeia (USP) Reference Standard, IMIDAZOLE, 1-(2-(ETHYLSULFONYL)ETHYL)-2-METHYL-4-NITRO-

Bioactivity: -

Solubility in Different Solvents

Solvent	Temperature [K]	Crystal form	Solubility [mg/mL]	Reference
2-Butoxyethanol	278.15	-	3.655	[150]
2-Butoxyethanol	283.15	-	4.077	[150]
2-Butoxyethanol	288.15	-	5.234	[150]
2-Butoxyethanol	293.15	-	7.03	[150]
2-Butoxyethanol	298.15	-	8.398	[150]
2-Butoxyethanol	303.15	-	10.13	[150]
2-Butoxyethanol	308.15	-	12.86	[150]
2-Butoxyethanol	313.15	-	15.41	[150]
2-Butoxyethanol	318.15	-	19.8	[150]
2-Butoxyethanol	323.15	-	24.68	[150]
2-Methoxyethanol	278.15	-	26.91	[150]
2-Methoxyethanol	283.15	-	32.57	[150]
2-Methoxyethanol	288.15	-	37.56	[150]
2-Methoxyethanol	293.15	-	46.13	[150]
2-Methoxyethanol	298.15	-	55.69	[150]
2-Methoxyethanol	303.15	-	66.45	[150]
2-Methoxyethanol	308.15	-	81.71	[150]
2-Methoxyethanol	313.15	-	99.68	[150]
2-Methoxyethanol	318.15	-	120.0	[150]
2-Methoxyethanol	323.15	-	147.6	[150]
Acetone	278.15	-	30.03	[150]
Acetone	283.15	-	38.01	[150]
Acetone	288.15	-	45.81	[150]
Acetone	293.15	-	54.97	[150]
Acetone	298.15	-	66.42	[150]
Acetone	303.15	-	79.29	[150]
Acetone	308.15	-	95.03	[150]
Acetone	313.15	-	117.7	[150]
Acetone	318.15	-	144.2	[150]
Acetone	323.15	-	175.6	[150]
Butyl acetate	278.15	-	3.805	[150]
Butyl acetate	283.15	-	4.464	[150]
Butyl acetate	288.15	-	5.477	[150]
Butyl acetate	293.15	-	6.746	[150]
Butyl acetate	298.15	-	7.89	[150]
Butyl acetate	303.15	-	9.556	[150]
Butyl acetate	308.15	-	11.45	[150]
Butyl acetate	313.15	-	13.67	[150]
Butyl acetate	318.15	-	16.53	[150]
Butyl acetate	323.15	-	19.71	[150]
Dimethylacetamide	278.15	-	145.3	[150]
Dimethylacetamide	283.15	-	163.2	[150]
Dimethylacetamide	288.15	-	188.1	[150]
Dimethylacetamide	293.15	-	214.9	[150]
Dimethylacetamide	298.15	-	241.0	[150]
Dimethylacetamide	303.15	-	275.7	[150]
Dimethylacetamide	308.15	-	314.3	[150]
Dimethylacetamide	313.15	-	361.7	[150]
Dimethylacetamide	318.15	-	411.1	[150]
Dimethylacetamide	323.15	-	470.7	[150]
Dimethylformamide	278.15	-	154.9	[150]
Dimethylformamide	283.15	-	178.2	[150]
Dimethylformamide	288.15	-	206.0	[150]
Dimethylformamide	293.15	-	238.2	[150]
Dimethylformamide	298.15	-	272.9	[150]
Dimethylformamide	303.15	-	316.3	[150]
Dimethylformamide	308.15	-	365.7	[150]
Dimethylformamide	313.15	-	423.1	[150]
Dimethylformamide	318.15	-	483.6	[150]
Dimethylformamide	323.15	-	559.4	[150]
Ethanol	278.15	-	1.133	[150]
Ethanol	283.15	-	1.606	[150]
Ethanol	288.15	-	2.041	[150]
Ethanol	293.15	-	2.82	[150]
Ethanol	298.15	-	3.527	[150]
Ethanol	303.15	-	5.044	[150]
Ethanol	308.15	-	6.695	[150]
Ethanol	313.15	-	8.585	[150]
Ethanol	318.15	-	11.44	[150]
Ethanol	323.15	-	15.5	[150]
Ethyl acetate	278.15	-	8.636	[150]
Ethyl acetate	283.15	-	10.61	[150]
Ethyl acetate	288.15	-	12.47	[150]
Ethyl acetate	293.15	-	14.48	[150]
Ethyl acetate	298.15	-	17.41	[150]
Ethyl acetate	303.15	-	20.73	[150]
Ethyl acetate	308.15	-	24.77	[150]
Ethyl acetate	313.15	-	29.43	[150]
Ethyl acetate	318.15	-	34.88	[150]
Ethyl acetate	323.15	-	41.27	[150]
Glycol monoethyl ether	278.15	-	9.264	[150]
Glycol monoethyl ether	283.15	-	11.32	[150]
Glycol monoethyl ether	288.15	-	13.57	[150]
Glycol monoethyl ether	293.15	-	16.61	[150]
Glycol monoethyl ether	298.15	-	20.27	[150]
Glycol monoethyl ether	303.15	-	24.42	[150]
Glycol monoethyl ether	308.15	-	30.5	[150]
Glycol monoethyl ether	313.15	-	37.22	[150]
Glycol monoethyl ether	318.15	-	45.86	[150]
Glycol monoethyl ether	323.15	-	56.29	[150]
Glycol monopropyl ether	278.15	-	4.846	[150]
Glycol monopropyl ether	283.15	-	5.719	[150]
Glycol monopropyl ether	288.15	-	7.183	[150]
Glycol monopropyl ether	293.15	-	9.331	[150]
Glycol monopropyl ether	298.15	-	11.12	[150]
Glycol monopropyl ether	303.15	-	13.42	[150]
Glycol monopropyl ether	308.15	-	16.73	[150]
Glycol monopropyl ether	313.15	-	20.72	[150]
Glycol monopropyl ether	318.15	-	26.21	[150]
Glycol monopropyl ether	323.15	-	32.78	[150]
Methanol	278.15	-	5.772	[150]
Methanol	283.15	-	7.334	[150]
Methanol	288.15	-	9.649	[150]
Methanol	293.15	-	12.05	[150]
Methanol	298.15	-	15.98	[150]
Methanol	303.15	-	20.88	[150]
Methanol	308.15	-	26.97	[150]
Methanol	313.15	-	35.81	[150]
Methanol	318.15	-	46.86	[150]
Methanol	323.15	-	61.91	[150]
Methyl acetate	278.15	-	17.82	[150]
Methyl acetate	283.15	-	21.41	[150]
Methyl acetate	288.15	-	25.01	[150]
Methyl acetate	293.15	-	29.88	[150]
Methyl acetate	298.15	-	35.67	[150]
Methyl acetate	303.15	-	41.69	[150]
Methyl acetate	308.15	-	49.44	[150]
Methyl acetate	313.15	-	58.02	[150]
Methyl acetate	318.15	-	68.47	[150]
Methyl acetate	323.15	-	78.83	[150]
N-Methyl-2-pyrrolidone	278.15	-	197.5	[150]
N-Methyl-2-pyrrolidone	283.15	-	227.3	[150]
N-Methyl-2-pyrrolidone	288.15	-	253.0	[150]
N-Methyl-2-pyrrolidone	293.15	-	282.4	[150]
N-Methyl-2-pyrrolidone	298.15	-	313.5	[150]
N-Methyl-2-pyrrolidone	303.15	-	356.4	[150]
N-Methyl-2-pyrrolidone	308.15	-	402.0	[150]
N-Methyl-2-pyrrolidone	313.15	-	446.3	[150]
N-Methyl-2-pyrrolidone	318.15	-	505.4	[150]
N-Methyl-2-pyrrolidone	323.15	-	561.2	[150]
Propyl acetate	278.15	-	5.594	[150]
Propyl acetate	283.15	-	6.849	[150]
Propyl acetate	288.15	-	8.199	[150]
Propyl acetate	293.15	-	9.852	[150]
Propyl acetate	298.15	-	11.68	[150]
Propyl acetate	303.15	-	14.09	[150]
Propyl acetate	308.15	-	16.66	[150]
Propyl acetate	313.15	-	20.06	[150]
Propyl acetate	318.15	-	24.04	[150]
Propyl acetate	323.15	-	28.38	[150]

Molecule 3D descriptors

Descriptor	Value
PMI1	806.6752
PMI2	1240.1453
PMI3	1459.7521
NPR1	0.5526
NPR2	0.8496
RadiusOfGyration	2.6628
InertialShapeFactor	0.0011
Eccentricity	0.8334
Asphericity	0.1078
SpherocityIndex	0.6710
PBF	1.2237