N-benzyl-2-{[5-(3,5-dimethoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[5-(3,5-dimethoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-benzyl-2-{[5-(3,5-dimethoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | V015-1257 |
| Compound Name: | N-benzyl-2-{[5-(3,5-dimethoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C26 H26 N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c(c2cc(cc(c2)OC)OC)nnc1SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.795 |
| logD: | 4.7949 |
| logSw: | -4.5529 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.971 |
| InChI Key: | BLTOPMSSKUDRJF-UHFFFAOYSA-N |