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 |