3-(3,3-diethoxypropyl)-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,3-diethoxypropyl)-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
3-(3,3-diethoxypropyl)-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-3890 |
| Compound Name: | 3-(3,3-diethoxypropyl)-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 444.52 |
| Molecular Formula: | C23 H25 F N2 O4 S |
| Smiles: | CCOC(CCN1C(=Nc2ccccc2C1=O)SCC(c1ccc(cc1)F)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.3186 |
| logD: | 3.3186 |
| logSw: | -3.8117 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.922 |
| InChI Key: | WNBJPHWPGLOYOW-UHFFFAOYSA-N |