N-(2,4-dimethoxyphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
N-(2,4-dimethoxyphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Compound characteristics
| Compound ID: | M379-0178 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C21 H23 N3 O3 |
| Smiles: | Cn1cc2CCN(Cc3cccc1c23)C(Nc1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4835 |
| logD: | 3.4835 |
| logSw: | -3.9117 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.736 |
| InChI Key: | BAXZYLGVVCPQLU-UHFFFAOYSA-N |