dimethyl 5-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzene-1,3-dicarboxylate
dimethyl 5-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C430-0116 |
| Compound Name: | dimethyl 5-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzene-1,3-dicarboxylate |
| Molecular Weight: | 474.47 |
| Molecular Formula: | C26 H22 N2 O7 |
| Smiles: | COC(c1cc(cc(c1)NC1c2ccccc2C(N1Cc1ccc2c(c1)OCO2)=O)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4564 |
| logD: | 4.4564 |
| logSw: | -4.4376 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.465 |
| InChI Key: | MFJZXFPYICUIPH-HSZRJFAPSA-N |