1-{[(2S,4S)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1115 |
| Compound Name: | 1-{[(2S,4S)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C16 H22 F N7 O2 |
| Smiles: | Cc1c(cn(C)n1)C(N1C[C@H](C[C@H]1Cn1cc(C(N(C)C)=O)nn1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | -1.2544 |
| logD: | -1.2544 |
| logSw: | -0.9511 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.508 |
| InChI Key: | OHCSXJVMCHYTEE-NWDGAFQWSA-N |