N-[(4-fluorophenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-[(4-fluorophenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S535-0222 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-4-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 333.45 |
| Molecular Formula: | C19 H28 F N3 O |
| Smiles: | C1CCN(C1)CC1CCCN(CC1)C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.508 |
| logD: | -0.616 |
| logSw: | -2.688 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4593 |
| InChI Key: | NJNVBDPWWHVEGX-QGZVFWFLSA-N |