2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)quinazolin-4(3H)-one
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)quinazolin-4(3H)-one
Compound characteristics
Compound ID: | V003-4373 |
Compound Name: | 2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)quinazolin-4(3H)-one |
Molecular Weight: | 431.31 |
Molecular Formula: | C21 H13 Cl2 F N2 O S |
Smiles: | C(c1ccc(c(c1)[Cl])[Cl])SC1=Nc2ccccc2C(N1c1cccc(c1)F)=O |
Stereo: | ACHIRAL |
logP: | 5.5689 |
logD: | 5.5688 |
logSw: | -5.9855 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 25.1595 |
InChI Key: | QLBZDLPHYRMHSI-UHFFFAOYSA-N |