2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
Compound ID: | G858-0470 |
Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
Molecular Weight: | 508.01 |
Molecular Formula: | C27 H23 Cl F N3 O2 S |
Smiles: | C1CCN(CC1)C(c1ccc2C(N(C(=Nc2c1)SCc1ccc(cc1)[Cl])c1ccc(cc1)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6716 |
logD: | 4.6714 |
logSw: | -4.8862 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 41.808 |
InChI Key: | JKEKFBUYBUYRSN-UHFFFAOYSA-N |