methyl 2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-1682 |
| Compound Name: | methyl 2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 542.61 |
| Molecular Formula: | C26 H30 N4 O7 S |
| Smiles: | COC(c1ccc2C(N(CCN3CCOCC3)C(=Nc2c1)SCC(Nc1ccc(cc1OC)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1719 |
| logD: | 2.1083 |
| logSw: | -3.0261 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.44 |
| InChI Key: | GWDVCVGOMJXSMC-UHFFFAOYSA-N |