ethyl 5-acetyl-2-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamido]-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamido]-4-methylthiophene-3-carboxylate
ethyl 5-acetyl-2-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamido]-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 1683-0519 |
| Compound Name: | ethyl 5-acetyl-2-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamido]-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 428.46 |
| Molecular Formula: | C21 H20 N2 O6 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(CCN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2224 |
| logD: | -0.9916 |
| logSw: | -2.902 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.994 |
| InChI Key: | HYDQKKYDRAMVKI-UHFFFAOYSA-N |