N-(2,4-difluorophenyl)-5-{[(3,4-dimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-5-{[(3,4-dimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(2,4-difluorophenyl)-5-{[(3,4-dimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L063-0732 |
Compound Name: | N-(2,4-difluorophenyl)-5-{[(3,4-dimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 438.47 |
Molecular Formula: | C18 H16 F2 N4 O3 S2 |
Smiles: | Cc1ccc(cc1C)S(NCc1nnc(C(Nc2ccc(cc2F)F)=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7457 |
logD: | 3.5204 |
logSw: | -3.9007 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.389 |
InChI Key: | DEZHQJMWTMHYDC-UHFFFAOYSA-N |