ethyl 4-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate
ethyl 4-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K284-2390 |
| Compound Name: | ethyl 4-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C19 H24 N4 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(CCCN1C(c2ccccc2NC1=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5919 |
| logD: | 1.5907 |
| logSw: | -2.5669 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.469 |
| InChI Key: | MPVGYXJYKOELHH-UHFFFAOYSA-N |