1-[(2,4-dimethoxyphenyl)methyl]-2-(3-methylthiophen-2-yl)azepane
Chemical Structure Depiction of
1-[(2,4-dimethoxyphenyl)methyl]-2-(3-methylthiophen-2-yl)azepane
1-[(2,4-dimethoxyphenyl)methyl]-2-(3-methylthiophen-2-yl)azepane
Compound characteristics
| Compound ID: | J006-1563 |
| Compound Name: | 1-[(2,4-dimethoxyphenyl)methyl]-2-(3-methylthiophen-2-yl)azepane |
| Molecular Weight: | 345.5 |
| Molecular Formula: | C20 H27 N O2 S |
| Smiles: | Cc1ccsc1C1CCCCCN1Cc1ccc(cc1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0516 |
| logD: | 4.8215 |
| logSw: | -4.7095 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.0827 |
| InChI Key: | UYRHIPZDODLVFY-SFHVURJKSA-N |