ethyl 1-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoyl]piperidine-3-carboxylate
ethyl 1-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | K288-0563 |
| Compound Name: | ethyl 1-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoyl]piperidine-3-carboxylate |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C23 H23 N3 O4 S |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc(cc1)N1C(c2ccccc2NC1=S)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7287 |
| logD: | 2.7229 |
| logSw: | -3.4399 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.042 |
| InChI Key: | UEXOKAIHDVZSTC-INIZCTEOSA-N |