4-{[(4,5-dibenzyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-{[(4,5-dibenzyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
4-{[(4,5-dibenzyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | V007-9632 |
| Compound Name: | 4-{[(4,5-dibenzyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide |
| Molecular Weight: | 572.65 |
| Molecular Formula: | C32 H27 F3 N4 O S |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)c1nnc(n1Cc1ccccc1)SCc1ccc(cc1)C(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2465 |
| logD: | 6.2465 |
| logSw: | -6.3114 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.359 |
| InChI Key: | AZTBBXANASGUDS-UHFFFAOYSA-N |