4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(pyridin-3-yl)methyl]butanamide
Chemical Structure Depiction of
4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(pyridin-3-yl)methyl]butanamide
4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(pyridin-3-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-7387 |
| Compound Name: | 4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(pyridin-3-yl)methyl]butanamide |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C22 H26 N4 O4 S |
| Smiles: | CCOc1cc2C(N(CCCC(NCc3cccnc3)=O)C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9925 |
| logD: | 0.9683 |
| logSw: | -2.0298 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.706 |
| InChI Key: | OKKXNOLKQMZRDE-UHFFFAOYSA-N |