2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[4-(difluoromethoxy)phenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[4-(difluoromethoxy)phenyl]quinazolin-4(3H)-one
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[4-(difluoromethoxy)phenyl]quinazolin-4(3H)-one
Compound characteristics
Compound ID: | K843-0027 |
Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[4-(difluoromethoxy)phenyl]quinazolin-4(3H)-one |
Molecular Weight: | 472.9 |
Molecular Formula: | C23 H15 Cl F2 N2 O3 S |
Smiles: | C(C(c1ccc(cc1)[Cl])=O)SC1=Nc2ccccc2C(N1c1ccc(cc1)OC(F)F)=O |
Stereo: | ACHIRAL |
logP: | 4.3815 |
logD: | 4.3812 |
logSw: | -4.7698 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 45.012 |
InChI Key: | WQHIVNDDBVHWGS-UHFFFAOYSA-N |