methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-2089 |
| Compound Name: | methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 554.62 |
| Molecular Formula: | C27 H30 N4 O7 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1=Nc2cc(ccc2C(N1CCN1CCOCC1)=O)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0281 |
| logD: | 2.9645 |
| logSw: | -3.5434 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.717 |
| InChI Key: | WNPKGVHZSUWUEH-UHFFFAOYSA-N |