N-[4-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-[4-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-[4-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1149 |
| Compound Name: | N-[4-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)phenyl]-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C27 H36 N4 O2 |
| Smiles: | C1CCCN(CC1)CCNC(Cc1ccc(cc1)NC(N1CCCCc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2643 |
| logD: | 2.4966 |
| logSw: | -4.1321 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.058 |
| InChI Key: | GADICCGWBKNQFX-UHFFFAOYSA-N |