ethyl 4-[(6-ethoxy-4-methylquinazolin-2-yl)sulfanyl]-3-oxobutanoate
Chemical Structure Depiction of
ethyl 4-[(6-ethoxy-4-methylquinazolin-2-yl)sulfanyl]-3-oxobutanoate
ethyl 4-[(6-ethoxy-4-methylquinazolin-2-yl)sulfanyl]-3-oxobutanoate
Compound characteristics
| Compound ID: | 3391-6630 |
| Compound Name: | ethyl 4-[(6-ethoxy-4-methylquinazolin-2-yl)sulfanyl]-3-oxobutanoate |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C17 H20 N2 O4 S |
| Smiles: | CCOC(CC(CSc1nc(C)c2cc(ccc2n1)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0829 |
| logD: | 3.0828 |
| logSw: | -3.1438 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 57.861 |
| InChI Key: | NHSYBLNUXNFULS-UHFFFAOYSA-N |