7-[4-([1,4'-bipiperidin]-1'-yl)-4-oxobutyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Chemical Structure Depiction of
7-[4-([1,4'-bipiperidin]-1'-yl)-4-oxobutyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
7-[4-([1,4'-bipiperidin]-1'-yl)-4-oxobutyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | K284-5237 |
| Compound Name: | 7-[4-([1,4'-bipiperidin]-1'-yl)-4-oxobutyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C23 H30 N4 O4 S |
| Smiles: | C1CCN(CC1)C1CCN(CC1)C(CCCN1C(c2cc3c(cc2NC1=S)OCO3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2953 |
| logD: | -1.2603 |
| logSw: | -3.0168 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.898 |
| InChI Key: | XAQWRIKGSCIICZ-UHFFFAOYSA-N |