N-(5-chloro-2,4-dimethoxyphenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide
Compound characteristics
| Compound ID: | J007-0368 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide |
| Molecular Weight: | 408.95 |
| Molecular Formula: | C20 H25 Cl N2 O3 S |
| Smiles: | Cc1ccc(C2CCCCCN2C(Nc2cc(c(cc2OC)OC)[Cl])=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5357 |
| logD: | 5.5355 |
| logSw: | -5.8758 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.042 |
| InChI Key: | WSMCKICSDKAVPU-INIZCTEOSA-N |