ethyl {4-[(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)amino]phenyl}acetate
Chemical Structure Depiction of
ethyl {4-[(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)amino]phenyl}acetate
ethyl {4-[(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)amino]phenyl}acetate
Compound characteristics
| Compound ID: | M379-0668 |
| Compound Name: | ethyl {4-[(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)amino]phenyl}acetate |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C24 H27 N3 O3 |
| Smiles: | CCn1cc2CCN(Cc3cccc1c23)C(Nc1ccc(CC(=O)OCC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6921 |
| logD: | 3.6921 |
| logSw: | -3.9285 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.588 |
| InChI Key: | XGWXMLOGVCPYTL-UHFFFAOYSA-N |