3-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
3-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | K284-3726 |
| Compound Name: | 3-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C26 H24 N4 O4 S |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCc1cccc(c1)[N+]([O-])=O)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5471 |
| logD: | 3.5471 |
| logSw: | -3.9033 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.444 |
| InChI Key: | GWXBIHVFXYKILO-UHFFFAOYSA-N |