2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | K263-0418 |
Compound Name: | 2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
Molecular Weight: | 511.66 |
Molecular Formula: | C29 H25 N3 O2 S2 |
Smiles: | C1Cc2ccccc2N(C1)C(CSC1=Nc2c3ccccc3sc2C(N1CCc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 6.0709 |
logD: | 6.0709 |
logSw: | -6.0195 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 39.301 |
InChI Key: | OOZKSHVZHFNGIJ-UHFFFAOYSA-N |