4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methylcyclohexyl)butanamide
Chemical Structure Depiction of
4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methylcyclohexyl)butanamide
4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methylcyclohexyl)butanamide
Compound characteristics
| Compound ID: | K284-7393 |
| Compound Name: | 4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methylcyclohexyl)butanamide |
| Molecular Weight: | 447.6 |
| Molecular Formula: | C23 H33 N3 O4 S |
| Smiles: | CCOc1cc2C(N(CCCC(NC3CCCCC3C)=O)C(Nc2cc1OCC)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9322 |
| logD: | 2.9104 |
| logSw: | -3.5232 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.304 |
| InChI Key: | JSMBCFBJFBNLQN-UHFFFAOYSA-N |