4-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(butan-2-yl)benzamide
Chemical Structure Depiction of
4-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(butan-2-yl)benzamide
4-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(butan-2-yl)benzamide
Compound characteristics
| Compound ID: | V003-3522 |
| Compound Name: | 4-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(butan-2-yl)benzamide |
| Molecular Weight: | 470.64 |
| Molecular Formula: | C28 H30 N4 O S |
| Salt: | not_available |
| Smiles: | CCC(C)NC(c1ccc(CSc2nnc(Cc3ccccc3)n2c2ccccc2C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8807 |
| logD: | 4.8807 |
| logSw: | -4.5518 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.514 |
| InChI Key: | FNDISICUNKRBOC-NRFANRHFSA-N |