N-benzyl-1-({(2S)-1-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0284 |
| Compound Name: | N-benzyl-1-({(2S)-1-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C22 H27 N7 O2 |
| Smiles: | Cc1cc(C)n(CC(N2CCC[C@H]2Cn2cc(C(NCc3ccccc3)=O)nn2)=O)n1 |
| Stereo: | ABSOLUTE |
| logP: | 0.6168 |
| logD: | 0.6168 |
| logSw: | -1.8695 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.305 |
| InChI Key: | RKHBOCCPPOSJBX-IBGZPJMESA-N |