3-[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide
3-[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | K284-3013 |
| Compound Name: | 3-[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide |
| Molecular Weight: | 525 |
| Molecular Formula: | C26 H22 Cl F N4 O3 S |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCC(Nc1ccccc1[Cl])=O)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.388 |
| logD: | 3.3879 |
| logSw: | -3.9036 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.672 |
| InChI Key: | VNETYTOFSVMPAD-UHFFFAOYSA-N |