2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0031 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 526 |
| Molecular Formula: | C27 H22 Cl F2 N3 O2 S |
| Smiles: | C1CCN(CC1)C(c1ccc2C(N(C(=Nc2c1)SCc1ccc(cc1[Cl])F)c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3005 |
| logD: | 5.3004 |
| logSw: | -5.8889 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.808 |
| InChI Key: | TYXZMJLYCMKFFD-UHFFFAOYSA-N |