1-{[(2S,4S)-4-fluoro-1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-4-fluoro-1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1325 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 321.31 |
| Molecular Formula: | C13 H16 F N7 O2 |
| Smiles: | Cc1cc(C(N2C[C@H](C[C@H]2Cn2cc(C(N)=O)nn2)F)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | -0.656 |
| logD: | -0.6561 |
| logSw: | -1.2087 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.972 |
| InChI Key: | OZHWIRBYAPQCEI-DTWKUNHWSA-N |