ethyl 4-{6-iodo-4-oxo-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-3(4H)-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{6-iodo-4-oxo-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-3(4H)-yl}benzoate
ethyl 4-{6-iodo-4-oxo-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-3(4H)-yl}benzoate
Compound characteristics
| Compound ID: | IB08-7434 |
| Compound Name: | ethyl 4-{6-iodo-4-oxo-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-3(4H)-yl}benzoate |
| Molecular Weight: | 528.37 |
| Molecular Formula: | C23 H17 I N2 O3 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(/C=C/c2cccs2)=Nc2ccc(cc2C1=O)I)=O |
| Stereo: | ACHIRAL |
| logP: | 5.94 |
| logD: | 5.94 |
| logSw: | -6.94 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 70.05 |
| InChI Key: | FJTRVBLIATYDNU-UHFFFAOYSA-N |