N-[(oxolan-2-yl)methyl]-2-({5-(pyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-2-({5-(pyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-[(oxolan-2-yl)methyl]-2-({5-(pyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | V014-3926 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-2-({5-(pyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 463.48 |
| Molecular Formula: | C21 H20 F3 N5 O2 S |
| Salt: | not_available |
| Smiles: | C1CC(CNC(CSc2nnc(c3cccnc3)n2c2cccc(c2)C(F)(F)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2696 |
| logD: | 2.2654 |
| logSw: | -2.4126 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.356 |
| InChI Key: | PZPPKUCFRFPGAM-QGZVFWFLSA-N |