N-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1151 |
| Compound Name: | N-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C25 H32 N4 O2 |
| Smiles: | C1CCN(C(Nc2ccc(CC(NCCN3CCCC3)=O)cc2)=O)c2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.404 |
| logD: | 1.1787 |
| logSw: | -3.5557 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.093 |
| InChI Key: | KRRRLXVAZZCASU-UHFFFAOYSA-N |