1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | C683-0047 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C28 H23 N3 O2 S |
| Smiles: | C1Cc2ccccc2N(C1)C(CSc1c2Cc3ccccc3Oc2nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0003 |
| logD: | 6.9973 |
| logSw: | -6.1636 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.188 |
| InChI Key: | MYSNYWSCTATOCY-UHFFFAOYSA-N |