ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate
ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K284-3901 |
| Compound Name: | ethyl 4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate |
| Molecular Weight: | 526.61 |
| Molecular Formula: | C26 H30 N4 O6 S |
| Smiles: | CCOC(N1CCC(CC1)N1C(=Nc2ccccc2C1=O)SCC(Nc1ccc(cc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3293 |
| logD: | 3.3292 |
| logSw: | -3.7887 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.398 |
| InChI Key: | XREVUONRHPTLDD-UHFFFAOYSA-N |