N-benzyl-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-benzyl-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S535-0254 |
| Compound Name: | N-benzyl-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 315.46 |
| Molecular Formula: | C19 H29 N3 O |
| Smiles: | C1CCN(C1)CC1CCCN(CC1)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4789 |
| logD: | -0.645 |
| logSw: | -2.6171 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4593 |
| InChI Key: | XMLYKBSXSVKYFU-GOSISDBHSA-N |