ethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2712-3576 |
| Compound Name: | ethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C26 H30 N2 O5 S |
| Smiles: | CCOC(c1c2CCC(C)Cc2sc1NC(CCCCCN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5481 |
| logD: | 2.2244 |
| logSw: | -4.33 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.088 |
| InChI Key: | RXJHKFKPYRVJIX-MRXNPFEDSA-N |