6-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)hexanoic acid
Chemical Structure Depiction of
6-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)hexanoic acid
6-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)hexanoic acid
Compound characteristics
| Compound ID: | K284-4982 |
| Compound Name: | 6-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)hexanoic acid |
| Molecular Weight: | 336.36 |
| Molecular Formula: | C15 H16 N2 O5 S |
| Smiles: | C(CCC(O)=O)CCN1C(c2cc3c(cc2NC1=S)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9656 |
| logD: | -0.8625 |
| logSw: | -2.8292 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.067 |
| InChI Key: | ZEKBCNKAPVOMFN-UHFFFAOYSA-N |