1-{[(2S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-0126 |
| Compound Name: | 1-{[(2S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 410.38 |
| Molecular Formula: | C17 H20 F2 N6 O4 |
| Smiles: | CNC(c1cn(C[C@@H]2CC(CN2C(c2ccc(nc2OC)OC)=O)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1142 |
| logD: | 1.1142 |
| logSw: | -2.309 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.542 |
| InChI Key: | JZUNUSOMIJCOKQ-SNVBAGLBSA-N |