diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate
diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 8008-0620 |
| Compound Name: | diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C21 H20 N2 O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(CN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8463 |
| logD: | 1.2237 |
| logSw: | -3.2791 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.942 |
| InChI Key: | KFUVWUVAWALCTM-UHFFFAOYSA-N |