1-({(2S,4S)-1-[3-(3,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-1-[3-(3,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-1-[3-(3,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1327 |
| Compound Name: | 1-({(2S,4S)-1-[3-(3,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 411.44 |
| Molecular Formula: | C20 H22 F N7 O2 |
| Smiles: | Cc1ccc(cc1C)c1cc(C(N2C[C@H](C[C@H]2Cn2cc(C(N)=O)nn2)F)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 2.0621 |
| logD: | 2.0611 |
| logSw: | -2.6672 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.894 |
| InChI Key: | CGZLIJPPCCRHIQ-LSDHHAIUSA-N |