butyl N-(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)glycinate
Chemical Structure Depiction of
butyl N-(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)glycinate
butyl N-(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)glycinate
Compound characteristics
| Compound ID: | M379-0741 |
| Compound Name: | butyl N-(1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carbonyl)glycinate |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C20 H27 N3 O3 |
| Smiles: | CCCCOC(CNC(N1CCc2cn(CC)c3cccc(C1)c23)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9578 |
| logD: | 2.9578 |
| logSw: | -3.2814 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.475 |
| InChI Key: | XXNAQQIVLJMROE-UHFFFAOYSA-N |