3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-2387 |
| Compound Name: | 3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | C(CC(N1CCN(CC1)c1ccccc1)=O)CN1C(c2ccccc2NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6894 |
| logD: | 2.6882 |
| logSw: | -3.5544 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.949 |
| InChI Key: | DBIKEVNWUWCEBJ-UHFFFAOYSA-N |