methyl 2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K289-0253 |
| Compound Name: | methyl 2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C23 H25 N3 O6 S |
| Smiles: | CCOc1ccc(cc1)NC(CSC1=Nc2cc(ccc2C(N1CCOC)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0449 |
| logD: | 3.0449 |
| logSw: | -3.6263 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.81 |
| InChI Key: | OPDSFWKOLGDQOQ-UHFFFAOYSA-N |