2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V006-6732 |
| Compound Name: | 2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 392.4 |
| Molecular Formula: | C18 H15 F3 N4 O S |
| Smiles: | Cc1nnc(n1c1cccc(c1)C(F)(F)F)SCc1ccccc1C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8108 |
| logD: | 2.8108 |
| logSw: | -3.4806 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.82 |
| InChI Key: | BYNMOYNNUCKLMZ-UHFFFAOYSA-N |