N-(2-chloro-4-methylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
N-(2-chloro-4-methylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Compound characteristics
| Compound ID: | M379-0517 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide |
| Molecular Weight: | 353.85 |
| Molecular Formula: | C20 H20 Cl N3 O |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(N1CCc2cn(C)c3cccc(C1)c23)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4621 |
| logD: | 4.4621 |
| logSw: | -4.4447 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5621 |
| InChI Key: | UWJTUELEBVPKOU-UHFFFAOYSA-N |