[(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3,4-dimethylphenyl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3,4-dimethylphenyl)methanone
[(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3,4-dimethylphenyl)methanone
Compound characteristics
| Compound ID: | SB35-1012 |
| Compound Name: | [(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3,4-dimethylphenyl)methanone |
| Molecular Weight: | 320.34 |
| Molecular Formula: | C16 H18 F2 N4 O |
| Smiles: | Cc1ccc(cc1C)C(N1CC(C[C@H]1c1nc(C)n[nH]1)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7706 |
| logD: | 2.7699 |
| logSw: | -3.0081 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.278 |
| InChI Key: | BGYBGFOMDPPQGZ-CYBMUJFWSA-N |