methyl 2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-1683 |
| Compound Name: | methyl 2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 531.03 |
| Molecular Formula: | C25 H27 Cl N4 O5 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSC1=Nc2cc(ccc2C(N1CCN1CCOCC1)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8169 |
| logD: | 3.7533 |
| logSw: | -4.273 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.964 |
| InChI Key: | QEUXPDFPKRJOMK-UHFFFAOYSA-N |