6,7-diethoxy-3-[3-(4-methylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6,7-diethoxy-3-[3-(4-methylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6,7-diethoxy-3-[3-(4-methylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-7499 |
| Compound Name: | 6,7-diethoxy-3-[3-(4-methylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 405.56 |
| Molecular Formula: | C21 H31 N3 O3 S |
| Smiles: | CCOc1cc2C(N(CCCN3CCC(C)CC3)C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0055 |
| logD: | 0.6933 |
| logSw: | -3.3516 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.699 |
| InChI Key: | JMZQEEJQRRVKMW-UHFFFAOYSA-N |