(4-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazin-1-yl)[2-(methylsulfanyl)pyridin-3-yl]methanone
Chemical Structure Depiction of
(4-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazin-1-yl)[2-(methylsulfanyl)pyridin-3-yl]methanone
(4-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazin-1-yl)[2-(methylsulfanyl)pyridin-3-yl]methanone
Compound characteristics
| Compound ID: | V001-6661 |
| Compound Name: | (4-{2-[(3-chlorophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazin-1-yl)[2-(methylsulfanyl)pyridin-3-yl]methanone |
| Molecular Weight: | 512.07 |
| Molecular Formula: | C27 H30 Cl N3 O3 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(CN1CCN(CC1)C(c1cccnc1SC)=O)OCc1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3966 |
| logD: | 4.3951 |
| logSw: | -4.5454 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.031 |
| InChI Key: | SZCRRAKPPSUJGK-VWLOTQADSA-N |