3-[2-(4-chlorophenyl)ethyl]-2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-6,7-dimethoxyquinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)ethyl]-2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-6,7-dimethoxyquinazolin-4(3H)-one
3-[2-(4-chlorophenyl)ethyl]-2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-6,7-dimethoxyquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-5988 |
| Compound Name: | 3-[2-(4-chlorophenyl)ethyl]-2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-6,7-dimethoxyquinazolin-4(3H)-one |
| Molecular Weight: | 550.08 |
| Molecular Formula: | C29 H28 Cl N3 O4 S |
| Smiles: | COc1cc2C(N(CCc3ccc(cc3)[Cl])C(=Nc2cc1OC)SCC(N1CCCc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5485 |
| logD: | 5.5485 |
| logSw: | -5.7275 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.067 |
| InChI Key: | PAOVOJQWWLBIAY-UHFFFAOYSA-N |