1-{[(2S,4S)-4-fluoro-1-(5-methylpyrazine-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-(5-methylpyrazine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-(5-methylpyrazine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1042 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-(5-methylpyrazine-2-carbonyl)pyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 361.38 |
| Molecular Formula: | C16 H20 F N7 O2 |
| Smiles: | Cc1cnc(cn1)C(N1C[C@H](C[C@H]1Cn1cc(C(N(C)C)=O)nn1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | -1.0273 |
| logD: | -1.0273 |
| logSw: | -0.6527 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 77.427 |
| InChI Key: | NGJGFZJGOKHKEZ-NWDGAFQWSA-N |