ethyl 8-({[4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)-2H,4H-1,3-benzodioxine-6-carboxylate
Chemical Structure Depiction of
ethyl 8-({[4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)-2H,4H-1,3-benzodioxine-6-carboxylate
ethyl 8-({[4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)-2H,4H-1,3-benzodioxine-6-carboxylate
Compound characteristics
| Compound ID: | K284-0755 |
| Compound Name: | ethyl 8-({[4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)-2H,4H-1,3-benzodioxine-6-carboxylate |
| Molecular Weight: | 502.59 |
| Molecular Formula: | C28 H26 N2 O5 S |
| Smiles: | CCOC(c1cc2COCOc2c(CSC2=Nc3ccccc3C(N2CCc2ccccc2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3321 |
| logD: | 5.3321 |
| logSw: | -5.2886 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.392 |
| InChI Key: | ZYTHACHDVUKSBG-UHFFFAOYSA-N |