1-{[3-methoxy-4-(2-methylpropoxy)phenyl]methyl}-2-(thiophen-2-yl)azepane
Chemical Structure Depiction of
1-{[3-methoxy-4-(2-methylpropoxy)phenyl]methyl}-2-(thiophen-2-yl)azepane
1-{[3-methoxy-4-(2-methylpropoxy)phenyl]methyl}-2-(thiophen-2-yl)azepane
Compound characteristics
| Compound ID: | J006-1668 |
| Compound Name: | 1-{[3-methoxy-4-(2-methylpropoxy)phenyl]methyl}-2-(thiophen-2-yl)azepane |
| Molecular Weight: | 373.56 |
| Molecular Formula: | C22 H31 N O2 S |
| Smiles: | CC(C)COc1ccc(CN2CCCCCC2c2cccs2)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5045 |
| logD: | 4.0081 |
| logSw: | -5.3827 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.1247 |
| InChI Key: | KSNWOLNFOKSTMW-IBGZPJMESA-N |