N-(2-bromophenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide
N-(2-bromophenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide
Compound characteristics
| Compound ID: | J007-0386 |
| Compound Name: | N-(2-bromophenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide |
| Molecular Weight: | 393.34 |
| Molecular Formula: | C18 H21 Br N2 O S |
| Smiles: | Cc1ccc(C2CCCCCN2C(Nc2ccccc2[Br])=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4996 |
| logD: | 5.4996 |
| logSw: | -5.2501 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.7815 |
| InChI Key: | KMAPXNAEUKOHMK-INIZCTEOSA-N |