3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide
Chemical Structure Depiction of
3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide
3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide
Compound characteristics
| Compound ID: | V030-0394 |
| Compound Name: | 3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(3-methylphenyl)benzamide |
| Molecular Weight: | 480.59 |
| Molecular Formula: | C28 H24 N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)NC(c1cccc(CSc2nnc(c3ccco3)n2c2cccc(C)c2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0122 |
| logD: | 6.012 |
| logSw: | -5.4308 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.382 |
| InChI Key: | GVGYBBTYSVRAJC-UHFFFAOYSA-N |