methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-1680 |
| Compound Name: | methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 517 |
| Molecular Formula: | C24 H25 Cl N4 O5 S |
| Smiles: | COC(c1ccc2C(N(CCN3CCOCC3)C(=Nc2c1)SCC(Nc1ccccc1[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4775 |
| logD: | 2.4139 |
| logSw: | -3.4943 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.266 |
| InChI Key: | GGCWHDAJVIKECB-UHFFFAOYSA-N |