2-{[(quinazolin-4-yl)sulfanyl]methyl}-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(quinazolin-4-yl)sulfanyl]methyl}-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
2-{[(quinazolin-4-yl)sulfanyl]methyl}-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Compound characteristics
Compound ID: | 4329-0133 |
Compound Name: | 2-{[(quinazolin-4-yl)sulfanyl]methyl}-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one |
Molecular Weight: | 464.47 |
Molecular Formula: | C24 H15 F3 N4 O S |
Smiles: | C(C1=Nc2ccccc2C(N1c1cccc(c1)C(F)(F)F)=O)Sc1c2ccccc2ncn1 |
Stereo: | ACHIRAL |
logP: | 4.491 |
logD: | 4.4347 |
logSw: | -4.4706 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.25 |
InChI Key: | BAIVPVRPBIJVCM-UHFFFAOYSA-N |