N-(2-methylphenyl)-5-{3-oxo-3-[3-(trifluoromethyl)anilino]propyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-{3-oxo-3-[3-(trifluoromethyl)anilino]propyl}-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-{3-oxo-3-[3-(trifluoromethyl)anilino]propyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-3949 |
| Compound Name: | N-(2-methylphenyl)-5-{3-oxo-3-[3-(trifluoromethyl)anilino]propyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 434.44 |
| Molecular Formula: | C20 H17 F3 N4 O2 S |
| Smiles: | Cc1ccccc1NC(c1nnc(CCC(Nc2cccc(c2)C(F)(F)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9535 |
| logD: | 3.9526 |
| logSw: | -4.07 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.509 |
| InChI Key: | CVMCUYGJPCGCBN-UHFFFAOYSA-N |