5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pentanoic acid
Chemical Structure Depiction of
5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pentanoic acid
5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pentanoic acid
Compound characteristics
| Compound ID: | K284-7618 |
| Compound Name: | 5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pentanoic acid |
| Molecular Weight: | 366.43 |
| Molecular Formula: | C17 H22 N2 O5 S |
| Smiles: | CCOc1cc2C(N(CCCCC(O)=O)C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4486 |
| logD: | -1.3796 |
| logSw: | -2.4227 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.372 |
| InChI Key: | SZRUEGTXDRCOTD-UHFFFAOYSA-N |