2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0605 |
| Compound Name: | 2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one |
| Molecular Weight: | 471.58 |
| Molecular Formula: | C27 H25 N3 O3 S |
| Smiles: | COc1ccccc1CN1C(=Nc2ccccc2C1=O)SCC(N1CCCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5516 |
| logD: | 4.5516 |
| logSw: | -4.4181 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.458 |
| InChI Key: | XEDCJRGFNLUGIZ-UHFFFAOYSA-N |