N-benzyl-1-({(2S)-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0214 |
| Compound Name: | N-benzyl-1-({(2S)-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | C1C[C@@H](Cn2cc(C(NCc3ccccc3)=O)nn2)N(C1)C(Cc1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1019 |
| logD: | 1.0934 |
| logSw: | -1.1017 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.816 |
| InChI Key: | MBHPIDDXEBFYNW-IBGZPJMESA-N |