7-[6-([1,4'-bipiperidin]-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-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
7-[6-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | K284-5159 |
| Compound Name: | 7-[6-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one |
| Molecular Weight: | 486.63 |
| Molecular Formula: | C25 H34 N4 O4 S |
| Smiles: | C(CCC(N1CCC(CC1)N1CCCCC1)=O)CCN1C(c2cc3c(cc2NC1=S)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3054 |
| logD: | -0.2502 |
| logSw: | -3.6416 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.898 |
| InChI Key: | QTRTXSRDNJGWDG-UHFFFAOYSA-N |