1-[(2,3-dimethoxyphenyl)methyl]-2-(5-methylthiophen-2-yl)azepane
Chemical Structure Depiction of
1-[(2,3-dimethoxyphenyl)methyl]-2-(5-methylthiophen-2-yl)azepane
1-[(2,3-dimethoxyphenyl)methyl]-2-(5-methylthiophen-2-yl)azepane
Compound characteristics
| Compound ID: | J006-1827 |
| Compound Name: | 1-[(2,3-dimethoxyphenyl)methyl]-2-(5-methylthiophen-2-yl)azepane |
| Molecular Weight: | 345.5 |
| Molecular Formula: | C20 H27 N O2 S |
| Smiles: | Cc1ccc(C2CCCCCN2Cc2cccc(c2OC)OC)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1121 |
| logD: | 2.3152 |
| logSw: | -4.9578 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.2559 |
| InChI Key: | OQYUCARTAIIEIG-KRWDZBQOSA-N |