[(2S)-2-(4-benzyl-4H-1,2,4-triazol-3-yl)-4,4-difluoropyrrolidin-1-yl](4-methoxy-2-methylphenyl)methanone
Chemical Structure Depiction of
[(2S)-2-(4-benzyl-4H-1,2,4-triazol-3-yl)-4,4-difluoropyrrolidin-1-yl](4-methoxy-2-methylphenyl)methanone
[(2S)-2-(4-benzyl-4H-1,2,4-triazol-3-yl)-4,4-difluoropyrrolidin-1-yl](4-methoxy-2-methylphenyl)methanone
Compound characteristics
| Compound ID: | S970-0708 |
| Compound Name: | [(2S)-2-(4-benzyl-4H-1,2,4-triazol-3-yl)-4,4-difluoropyrrolidin-1-yl](4-methoxy-2-methylphenyl)methanone |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C22 H22 F2 N4 O2 |
| Smiles: | Cc1cc(ccc1C(N1CC(C[C@H]1c1nncn1Cc1ccccc1)(F)F)=O)OC |
| Stereo: | ABSOLUTE |
| logP: | 3.3694 |
| logD: | 3.3694 |
| logSw: | -3.6515 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.509 |
| InChI Key: | YWEUXAVMCJCFKV-LJQANCHMSA-N |