diethyl 5-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
diethyl 5-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 1988-1822 |
| Compound Name: | diethyl 5-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 419.45 |
| Molecular Formula: | C20 H21 N O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(C1COc2ccccc2O1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.58 |
| logD: | 0.7896 |
| logSw: | -3.8082 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.068 |
| InChI Key: | KLASMDTYILEZIY-AWEZNQCLSA-N |