1-{[(2S,4S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0074 |
| Compound Name: | 1-{[(2S,4S)-1-(2,6-dimethoxypyridine-3-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 406.42 |
| Molecular Formula: | C18 H23 F N6 O4 |
| Smiles: | CN(C)C(c1cn(C[C@@H]2C[C@@H](CN2C(c2ccc(nc2OC)OC)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4959 |
| logD: | 0.4959 |
| logSw: | -1.9026 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.707 |
| InChI Key: | LVNVFCSGENKYRZ-NWDGAFQWSA-N |