4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | K284-7510 |
| Compound Name: | 4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 563.67 |
| Molecular Formula: | C30 H33 N3 O6 S |
| Smiles: | CCOc1cc2C(N(Cc3ccc(cc3)C(NCCc3ccc(c(c3)OC)OC)=O)C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2784 |
| logD: | 3.2713 |
| logSw: | -3.5149 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.254 |
| InChI Key: | BJKSMHAHCOAEHM-UHFFFAOYSA-N |