2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)quinazolin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)quinazolin-4(3H)-one
Compound characteristics
Compound ID: | V005-9613 |
Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)quinazolin-4(3H)-one |
Molecular Weight: | 396.87 |
Molecular Formula: | C21 H14 Cl F N2 O S |
Smiles: | C(c1cccc(c1)[Cl])SC1=Nc2ccccc2C(N1c1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 4.8608 |
logD: | 4.8607 |
logSw: | -4.9603 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 25.1595 |
InChI Key: | PCBZKCJWYPVFRL-UHFFFAOYSA-N |