4-[2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
4-[2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-methoxyethyl)benzamide
4-[2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | K289-0503 |
| Compound Name: | 4-[2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 552.45 |
| Molecular Formula: | C26 H22 Br N3 O4 S |
| Smiles: | COCCNC(c1ccc(cc1)N1C(=Nc2ccccc2C1=O)SCC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5252 |
| logD: | 3.5249 |
| logSw: | -3.9566 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.275 |
| InChI Key: | YHDKZDFWKOQBQE-UHFFFAOYSA-N |