7-[6-(4-benzylpiperazin-1-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Chemical Structure Depiction of
7-[6-(4-benzylpiperazin-1-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
7-[6-(4-benzylpiperazin-1-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | K284-5167 |
| Compound Name: | 7-[6-(4-benzylpiperazin-1-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C26 H30 N4 O4 S |
| Smiles: | C(CCC(N1CCN(CC1)Cc1ccccc1)=O)CCN1C(c2cc3c(cc2NC1=S)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2733 |
| logD: | 3.2184 |
| logSw: | -3.4882 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.345 |
| InChI Key: | HUHIYMIPBNWFHJ-UHFFFAOYSA-N |