1-{[(2S,4S)-4-fluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-4-fluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1054 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-(6-methylpyridine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 360.39 |
| Molecular Formula: | C17 H21 F N6 O2 |
| Smiles: | Cc1cccc(C(N2C[C@H](C[C@H]2Cn2cc(C(N(C)C)=O)nn2)F)=O)n1 |
| Stereo: | ABSOLUTE |
| logP: | -0.1959 |
| logD: | -0.1959 |
| logSw: | -1.0854 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.768 |
| InChI Key: | KQJZYPMFUANYJR-QWHCGFSZSA-N |