N-(butan-2-yl)-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-(butan-2-yl)-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V025-4565 |
| Compound Name: | N-(butan-2-yl)-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 462.64 |
| Molecular Formula: | C25 H26 N4 O S2 |
| Salt: | not_available |
| Smiles: | CCC(C)NC(c1ccc(CSc2nnc(c3cccs3)n2c2cccc(C)c2)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0769 |
| logD: | 5.0766 |
| logSw: | -4.7247 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.857 |
| InChI Key: | HVZQQJWLFSHREW-SFHVURJKSA-N |