N-(3-methylphenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-(3-methylphenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-(3-methylphenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S534-0224 |
| Compound Name: | N-(3-methylphenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 315.46 |
| Molecular Formula: | C19 H29 N3 O |
| Smiles: | Cc1cccc(c1)NC(N1CCCCCC1CN1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4184 |
| logD: | 0.5086 |
| logSw: | -3.5042 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.7834 |
| InChI Key: | NOAAVZLZYXLERR-GOSISDBHSA-N |