ethyl 2-{2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3235-0089 |
| Compound Name: | ethyl 2-{2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamido]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 531.59 |
| Molecular Formula: | C28 H25 N3 O6 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1ccccc1NC(CN1C(c2ccccc2C1=O)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9663 |
| logD: | 1.1184 |
| logSw: | -4.2465 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.503 |
| InChI Key: | OGKKVGNKJFQIES-UHFFFAOYSA-N |