ethyl 3-oxo-4-[(4,6,7-trimethylquinazolin-2-yl)sulfanyl]butanoate
Chemical Structure Depiction of
ethyl 3-oxo-4-[(4,6,7-trimethylquinazolin-2-yl)sulfanyl]butanoate
ethyl 3-oxo-4-[(4,6,7-trimethylquinazolin-2-yl)sulfanyl]butanoate
Compound characteristics
| Compound ID: | 3391-6628 |
| Compound Name: | ethyl 3-oxo-4-[(4,6,7-trimethylquinazolin-2-yl)sulfanyl]butanoate |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C17 H20 N2 O3 S |
| Smiles: | CCOC(CC(CSc1nc(C)c2cc(C)c(C)cc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6875 |
| logD: | 3.6874 |
| logSw: | -3.9187 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.737 |
| InChI Key: | PFELRSGDFBUHFQ-UHFFFAOYSA-N |