N-(4-{[2-(pyrrolidin-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-(4-{[2-(pyrrolidin-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-(4-{[2-(pyrrolidin-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | C796-0778 |
| Compound Name: | N-(4-{[2-(pyrrolidin-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 406.53 |
| Molecular Formula: | C24 H30 N4 O2 |
| Smiles: | C1CCN(C(Nc2ccc(cc2)C(NCCN2CCCC2)=O)=O)c2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.6775 |
| logD: | 2.2693 |
| logSw: | -4.0366 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.306 |
| InChI Key: | ASFSZIPNBSQETO-UHFFFAOYSA-N |