N-(4-bromo-2-fluorophenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
N-(4-bromo-2-fluorophenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide
Compound characteristics
| Compound ID: | M379-0539 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indole-5-carboxamide |
| Molecular Weight: | 402.26 |
| Molecular Formula: | C19 H17 Br F N3 O |
| Smiles: | Cn1cc2CCN(Cc3cccc1c23)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4188 |
| logD: | 4.4181 |
| logSw: | -4.4141 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5621 |
| InChI Key: | QJLABBVIGZJVRN-UHFFFAOYSA-N |