N-cyclopropyl-2-({[4-(2-methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-cyclopropyl-2-({[4-(2-methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-cyclopropyl-2-({[4-(2-methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V026-6705 |
| Compound Name: | N-cyclopropyl-2-({[4-(2-methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | Cc1nnc(n1c1ccccc1OC)SCc1ccccc1C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9996 |
| logD: | 2.9995 |
| logSw: | -3.6547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.56 |
| InChI Key: | QNAAIKBZFNKCHI-UHFFFAOYSA-N |