N-[(4-methylphenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-[(4-methylphenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S535-0250 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 329.48 |
| Molecular Formula: | C20 H31 N3 O |
| Smiles: | Cc1ccc(CNC(N2CCCC(CC2)CN2CCCC2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9023 |
| logD: | -0.2217 |
| logSw: | -3.1259 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4593 |
| InChI Key: | YLBCPNMKWGSWRB-LJQANCHMSA-N |