4-({[5-benzyl-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
4-({[5-benzyl-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
4-({[5-benzyl-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V025-4477 |
| Compound Name: | 4-({[5-benzyl-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide |
| Molecular Weight: | 470.64 |
| Molecular Formula: | C28 H30 N4 O S |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1ccc(CSc2nnc(Cc3ccccc3)n2c2ccc(C)cc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8973 |
| logD: | 4.8973 |
| logSw: | -4.6461 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.089 |
| InChI Key: | BXNLOLYYJACKDJ-UHFFFAOYSA-N |