N-benzyl-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
N-benzyl-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Compound characteristics
| Compound ID: | M379-0672 |
| Compound Name: | N-benzyl-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide |
| Molecular Weight: | 333.43 |
| Molecular Formula: | C21 H23 N3 O |
| Smiles: | CCn1cc2CCN(Cc3cccc1c23)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2644 |
| logD: | 3.2644 |
| logSw: | -3.3602 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.751 |
| InChI Key: | XESRMGYSXAZIEY-UHFFFAOYSA-N |