2-({5-[(benzylsulfanyl)methyl]-4-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
2-({5-[(benzylsulfanyl)methyl]-4-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
2-({5-[(benzylsulfanyl)methyl]-4-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y203-0276 |
| Compound Name: | 2-({5-[(benzylsulfanyl)methyl]-4-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 438.49 |
| Molecular Formula: | C19 H17 F3 N4 O S2 |
| Smiles: | C(c1ccccc1)SCc1nnc(n1c1ccccc1C(F)(F)F)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3641 |
| logD: | 3.3641 |
| logSw: | -3.9231 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.047 |
| InChI Key: | APNHYTYTZNWVMW-UHFFFAOYSA-N |