ethyl ({3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
ethyl ({3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | K284-0612 |
| Compound Name: | ethyl ({3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C20 H18 N2 O5 S |
| Smiles: | CCOC(CSC1=Nc2ccccc2C(N1Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2478 |
| logD: | 3.2478 |
| logSw: | -3.673 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.317 |
| InChI Key: | JSXJCWRZRQQTER-UHFFFAOYSA-N |