diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamido]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamido]-3-methylthiophene-2,4-dicarboxylate
diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamido]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 1683-0614 |
| Compound Name: | diethyl 5-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamido]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 534.59 |
| Molecular Formula: | C28 H26 N2 O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(C(Cc1ccccc1)N1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1822 |
| logD: | 2.7112 |
| logSw: | -5.2071 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.81 |
| InChI Key: | YBVHOGZOEBJSMY-FQEVSTJZSA-N |