1-{[(2S,4S)-4-fluoro-1-(1-methyl-1H-pyrrole-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-(1-methyl-1H-pyrrole-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-(1-methyl-1H-pyrrole-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1064 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-(1-methyl-1H-pyrrole-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C16 H21 F N6 O2 |
| Smiles: | CN(C)C(c1cn(C[C@@H]2C[C@@H](CN2C(c2cccn2C)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.1495 |
| logD: | 0.1495 |
| logSw: | -0.9314 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.763 |
| InChI Key: | PEPMGAIKEKHIKK-NWDGAFQWSA-N |