3-[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
3-[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | K284-3736 |
| Compound Name: | 3-[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H24 F N3 O2 S |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCc1cccc(c1)F)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8071 |
| logD: | 3.8071 |
| logSw: | -4.061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.062 |
| InChI Key: | XDXGXLJQKDALRY-UHFFFAOYSA-N |