6,7-diethoxy-3-[5-oxo-5-(4-phenylpiperazin-1-yl)pentyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6,7-diethoxy-3-[5-oxo-5-(4-phenylpiperazin-1-yl)pentyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6,7-diethoxy-3-[5-oxo-5-(4-phenylpiperazin-1-yl)pentyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-7640 |
| Compound Name: | 6,7-diethoxy-3-[5-oxo-5-(4-phenylpiperazin-1-yl)pentyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 510.66 |
| Molecular Formula: | C27 H34 N4 O4 S |
| Smiles: | CCOc1cc2C(N(CCCCC(N3CCN(CC3)c3ccccc3)=O)C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0751 |
| logD: | 3.0532 |
| logSw: | -3.4543 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.37 |
| InChI Key: | BNUKDMOLWOHLTB-UHFFFAOYSA-N |