[(2S)-4,4-difluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](3,4-dimethylphenyl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](3,4-dimethylphenyl)methanone
[(2S)-4,4-difluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](3,4-dimethylphenyl)methanone
Compound characteristics
| Compound ID: | SB36-0991 |
| Compound Name: | [(2S)-4,4-difluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](3,4-dimethylphenyl)methanone |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C21 H25 F2 N5 O2 |
| Smiles: | Cc1ccc(cc1C)C(N1CC(C[C@H]1Cn1cc(C(N2CCCC2)=O)nn1)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7383 |
| logD: | 2.7383 |
| logSw: | -2.7099 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.36 |
| InChI Key: | QFQIDIMJZXYAJW-QGZVFWFLSA-N |