3-({[5-benzyl-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
3-({[5-benzyl-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
3-({[5-benzyl-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V027-9467 |
| Compound Name: | 3-({[5-benzyl-4-(2-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(c1cccc(CSc2nnc(Cc3ccccc3)n2c2ccccc2F)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6353 |
| logD: | 4.6353 |
| logSw: | -4.4662 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.788 |
| InChI Key: | ULAKLWMMPFLQFC-UHFFFAOYSA-N |