3-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide
3-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | K284-3020 |
| Compound Name: | 3-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(4-fluorophenyl)methyl]propanamide |
| Molecular Weight: | 504.58 |
| Molecular Formula: | C27 H25 F N4 O3 S |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCC(NCc1ccccc1)=O)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0186 |
| logD: | 3.0186 |
| logSw: | -3.6746 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.692 |
| InChI Key: | CGFGIGZYSYOGEW-UHFFFAOYSA-N |