2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide
Chemical Structure Depiction of
2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide
2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide
Compound characteristics
| Compound ID: | V003-3208 |
| Compound Name: | 2-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide |
| Molecular Weight: | 398.91 |
| Molecular Formula: | C20 H19 Cl N4 O S |
| Salt: | not_available |
| Smiles: | Cc1nnc(n1c1cccc(c1)[Cl])SCc1ccccc1C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8316 |
| logD: | 3.8315 |
| logSw: | -4.207 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.231 |
| InChI Key: | QWMVKFFDKGENAV-UHFFFAOYSA-N |