4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[4-(propan-2-yl)phenyl]benzamide
Chemical Structure Depiction of
4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[4-(propan-2-yl)phenyl]benzamide
4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[4-(propan-2-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | V025-4443 |
| Compound Name: | 4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[4-(propan-2-yl)phenyl]benzamide |
| Molecular Weight: | 524.64 |
| Molecular Formula: | C30 H28 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC(c1ccc(CSc2nnc(c3ccco3)n2c2ccccc2OC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0076 |
| logD: | 6.0073 |
| logSw: | -5.5638 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.712 |
| InChI Key: | BDJAKYIJIRAOGW-UHFFFAOYSA-N |