4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V028-0357 |
| Compound Name: | 4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C27 H27 F N4 O S |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1ccc(CSc2nnc(Cc3ccccc3)n2c2ccc(cc2)F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.503 |
| logD: | 4.503 |
| logSw: | -4.329 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.089 |
| InChI Key: | OUKRHPUTZJVSIF-UHFFFAOYSA-N |