2-(5-methylthiophen-2-yl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane
Chemical Structure Depiction of
2-(5-methylthiophen-2-yl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane
2-(5-methylthiophen-2-yl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane
Compound characteristics
| Compound ID: | J006-1366 |
| Compound Name: | 2-(5-methylthiophen-2-yl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane |
| Molecular Weight: | 375.53 |
| Molecular Formula: | C21 H29 N O3 S |
| Smiles: | Cc1ccc(C2CCCCCN2Cc2ccc(c(c2OC)OC)OC)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0342 |
| logD: | 2.4978 |
| logSw: | -4.6408 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.973 |
| InChI Key: | BLAFDTIQJUWGBS-KRWDZBQOSA-N |