2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V009-7813 |
| Compound Name: | 2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 523.98 |
| Molecular Formula: | C22 H17 Cl F3 N5 O S2 |
| Salt: | not_available |
| Smiles: | Cc1nnc(n1c1cccc(c1)[Cl])SCc1nc(cs1)C(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9625 |
| logD: | 4.9624 |
| logSw: | -5.0701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.675 |
| InChI Key: | MXPNPNBLVXOKFZ-UHFFFAOYSA-N |