(1-{[(2S)-4,4-difluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-4,4-difluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
(1-{[(2S)-4,4-difluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB36-1036 |
| Compound Name: | (1-{[(2S)-4,4-difluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 404.42 |
| Molecular Formula: | C19 H22 F2 N6 O2 |
| Smiles: | Cc1cccc(C(N2CC(C[C@H]2Cn2cc(C(N3CCCC3)=O)nn2)(F)F)=O)n1 |
| Stereo: | ABSOLUTE |
| logP: | 1.3436 |
| logD: | 1.3436 |
| logSw: | -1.6358 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.782 |
| InChI Key: | OUBXUEDPMKXQRV-CQSZACIVSA-N |