methyl 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-0248 |
| Compound Name: | methyl 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 456.47 |
| Molecular Formula: | C22 H20 N2 O7 S |
| Smiles: | CCOC(CSC1=Nc2cc(ccc2C(N1Cc1ccc2c(c1)OCO2)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5393 |
| logD: | 3.5393 |
| logSw: | -3.7726 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.491 |
| InChI Key: | VCUAZRYNNVYURT-UHFFFAOYSA-N |