3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-2819 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C26 H23 F N2 O4 S |
| Smiles: | COc1ccc(CCN2C(=Nc3ccccc3C2=O)SCC(c2ccc(cc2)F)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.938 |
| logD: | 3.938 |
| logSw: | -4.0788 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.257 |
| InChI Key: | IIDNAINHVZYAGV-UHFFFAOYSA-N |