ethyl 4-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperazine-1-carboxylate
ethyl 4-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K284-5320 |
| Compound Name: | ethyl 4-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperazine-1-carboxylate |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C19 H22 N4 O6 S |
| Smiles: | CCOC(N1CCN(CC1)C(CCN1C(c2cc3c(cc2NC1=S)OCO3)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4784 |
| logD: | 1.4515 |
| logSw: | -2.5987 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.584 |
| InChI Key: | VMLZSSOKRCONJZ-UHFFFAOYSA-N |