2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one
2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | K297-0862 |
| Compound Name: | 2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one |
| Molecular Weight: | 449.5 |
| Molecular Formula: | C24 H20 F N3 O3 S |
| Smiles: | COc1cc(cc(c1)OC)Nc1c2ccccc2nc(n1)SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7241 |
| logD: | 5.7241 |
| logSw: | -5.7193 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.862 |
| InChI Key: | JRFBUPKLUBNBNF-UHFFFAOYSA-N |