1-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperidine-4-carboxamide
1-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K284-5316 |
| Compound Name: | 1-[3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanoyl]piperidine-4-carboxamide |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C18 H20 N4 O5 S |
| Smiles: | C1CN(CCC1C(N)=O)C(CCN1C(c2cc3c(cc2NC1=S)OCO3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3203 |
| logD: | 0.2934 |
| logSw: | -2.3543 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.863 |
| InChI Key: | CYLMVAVRRTYPOK-UHFFFAOYSA-N |