1-{[(2S)-1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S)-1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S)-1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-0171 |
| Compound Name: | 1-{[(2S)-1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 367.36 |
| Molecular Formula: | C15 H19 F2 N7 O2 |
| Smiles: | Cc1cc(C(N2CC(C[C@H]2Cn2cc(C(NC)=O)nn2)(F)F)=O)nn1C |
| Stereo: | ABSOLUTE |
| logP: | -0.4723 |
| logD: | -0.4723 |
| logSw: | -1.1296 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.668 |
| InChI Key: | HHGIFYMEJYWZBU-SNVBAGLBSA-N |