[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-4-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](1-ethyl-1H-pyrazol-4-yl)methanone
[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-4-yl)methanone
Compound characteristics
| Compound ID: | S970-0861 |
| Compound Name: | [(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-4-yl)methanone |
| Molecular Weight: | 404.39 |
| Molecular Formula: | C19 H19 F3 N6 O |
| Smiles: | CCn1cc(cn1)C(N1CC(C[C@H]1c1nncn1Cc1ccc(cc1)F)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6365 |
| logD: | 1.6365 |
| logSw: | -1.9351 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.467 |
| InChI Key: | WNQZKSURNWHNLP-INIZCTEOSA-N |