N-(3-chloro-4-methoxyphenyl)-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
N-(3-chloro-4-methoxyphenyl)-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Compound characteristics
| Compound ID: | M379-0726 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-1-ethyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide |
| Molecular Weight: | 383.88 |
| Molecular Formula: | C21 H22 Cl N3 O2 |
| Smiles: | CCn1cc2CCN(Cc3cccc1c23)C(Nc1ccc(c(c1)[Cl])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1475 |
| logD: | 4.1475 |
| logSw: | -4.4874 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.059 |
| InChI Key: | JVNHFQHHFHYYJM-UHFFFAOYSA-N |