Lotifazole
Basic information
- CAS
71119-10-3- Standard SMILES
O=C(Nc1nc(-c2ccccc2)cs1)OCC(Cl)(Cl)Cl- InChIKey
SMQXDOVGKKMUIZ-UHFFFAOYSA-N- Molecular formula
- C12H9Cl3N2O2S
- Average molar mass
- 351.6 g/mol
- Monoisotopic mass
- 349.945032
Overview
Lotifazole is a small molecule drug. Lotifazole has a monoisotopic molecular weight of 349.95 Da.
Names & identifiers
- Preferred name
- Lotifazole
- IUPAC
- 2,2,2-trichloroethyl N-(4-phenyl-1,3-thiazol-2-yl)carbamate
- English name
- Lotifazole
- Molecular formula
- C12H9Cl3N2O2S
- Molecular weight
- 351.64
Names & synonyms
Lotifazole71119-10-3LotifazolLotifazolumNSC-3584821B3TF200TIF 1686DTXSID10221325F-1686RefChem:154122DTXCID10143816Lotifazole [INN]
Show more names
(4-Phenylthiazol-2-yl)carbamic acid 2,2,2-trichloroethyl esterCarbamic acid, N-(4-phenyl-2-thiazolyl)-, 2,2,2-trichloroethyl ester
2,2,2-trichloroethyl N-(4-phenyl-1,3-thiazol-2-yl)carbamate2,2,2-Trichloroethyl 4-phenyl-2-thiazolecarbamateNSC3584822,2,2-Trichloroethyl (4-phenylthiazol-2-yl)carbamateLotifazol [INN-Spanish]Lotifazolum [INN-Latin]NSC 358482UNII-1B3TF200TI
Database identifiers
- CAS
71119-10-3- PubChem CID
- 68905
- DTXSID
DTXSID10221325- ChEMBL
CHEMBL2105113- UNII
- 1B3TF200TI
- Nikkaji
- J138.392B
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 335
Physicochemical properties
- Density
- 1.545 · 1.545±0.06 g/cm3(Predicted)
- pka
- 4.06 · 4.06±0.70(Predicted)
- FDA UNII
- 1 B3TF200TI · 1B3TF200TI
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Related reactions
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Compound notes
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