1-({(2S)-1-[(azepan-1-yl)acetyl]pyrrolidin-2-yl}methyl)-N-benzyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S)-1-[(azepan-1-yl)acetyl]pyrrolidin-2-yl}methyl)-N-benzyl-1H-1,2,3-triazole-4-carboxamide
1-({(2S)-1-[(azepan-1-yl)acetyl]pyrrolidin-2-yl}methyl)-N-benzyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1068 |
| Compound Name: | 1-({(2S)-1-[(azepan-1-yl)acetyl]pyrrolidin-2-yl}methyl)-N-benzyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 424.55 |
| Molecular Formula: | C23 H32 N6 O2 |
| Smiles: | C1CCCN(CC1)CC(N1CCC[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.7547 |
| logD: | 0.7531 |
| logSw: | -2.0482 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.633 |
| InChI Key: | SUZYRYIUXDINPT-FQEVSTJZSA-N |