7-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Chemical Structure Depiction of
7-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
7-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | K284-5195 |
| Compound Name: | 7-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one |
| Molecular Weight: | 480.59 |
| Molecular Formula: | C25 H28 N4 O4 S |
| Smiles: | C(CCC(N1CCN(CC1)c1ccccc1)=O)CCN1C(c2cc3c(cc2NC1=S)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5922 |
| logD: | 3.5703 |
| logSw: | -3.794 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.065 |
| InChI Key: | YVLAYYMJGPAEQA-UHFFFAOYSA-N |