[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](2-methylpyridin-3-yl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](2-methylpyridin-3-yl)methanone
[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](2-methylpyridin-3-yl)methanone
Compound characteristics
| Compound ID: | S970-0818 |
| Compound Name: | [(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](2-methylpyridin-3-yl)methanone |
| Molecular Weight: | 401.39 |
| Molecular Formula: | C20 H18 F3 N5 O |
| Smiles: | Cc1c(cccn1)C(N1CC(C[C@H]1c1nncn1Cc1ccc(cc1)F)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.163 |
| logD: | 2.1628 |
| logSw: | -2.8336 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.59 |
| InChI Key: | DFCQTRXGJYPGKS-KRWDZBQOSA-N |