N-(3-acetylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
N-(3-acetylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Compound characteristics
| Compound ID: | M379-0598 |
| Compound Name: | N-(3-acetylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide |
| Molecular Weight: | 347.42 |
| Molecular Formula: | C21 H21 N3 O2 |
| Smiles: | CC(c1cccc(c1)NC(N1CCc2cn(C)c3cccc(C1)c23)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0832 |
| logD: | 3.0832 |
| logSw: | -3.3937 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.087 |
| InChI Key: | IMENOPVIURAWQU-UHFFFAOYSA-N |