3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
Chemical Structure Depiction of
3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V030-0407 |
| Compound Name: | 3-({[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide |
| Molecular Weight: | 481.58 |
| Molecular Formula: | C27 H23 N5 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccco2)nnc1SCc1cccc(c1)C(NCc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9616 |
| logD: | 3.9582 |
| logSw: | -3.9219 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.132 |
| InChI Key: | ZSODIWFMHJPUCS-UHFFFAOYSA-N |