N-{2-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]-6-iodo-4-oxo-1,4-dihydroquinazolin-3(2H)-yl}-4-[(prop-2-en-1-yl)oxy]benzamide
Chemical Structure Depiction of
N-{2-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]-6-iodo-4-oxo-1,4-dihydroquinazolin-3(2H)-yl}-4-[(prop-2-en-1-yl)oxy]benzamide
N-{2-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]-6-iodo-4-oxo-1,4-dihydroquinazolin-3(2H)-yl}-4-[(prop-2-en-1-yl)oxy]benzamide
Compound characteristics
| Compound ID: | Y508-6418 |
| Compound Name: | N-{2-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]-6-iodo-4-oxo-1,4-dihydroquinazolin-3(2H)-yl}-4-[(prop-2-en-1-yl)oxy]benzamide |
| Molecular Weight: | 581.41 |
| Molecular Formula: | C27 H24 I N3 O4 |
| Smiles: | C=CCc1cccc(C2Nc3ccc(cc3C(N2NC(c2ccc(cc2)OCC=C)=O)=O)I)c1O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4055 |
| logD: | 5.5612 |
| logSw: | -5.9735 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.641 |
| InChI Key: | PCXOXORMIDDTKK-RUZDIDTESA-N |