dimethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
dimethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Compound characteristics
| Compound ID: | 4973-0050 |
| Compound Name: | dimethyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate |
| Molecular Weight: | 498.55 |
| Molecular Formula: | C25 H26 N2 O7 S |
| Smiles: | COC(C1CCc2c1c(C(=O)OC)c(NC(CCCCCN1C(c3ccccc3C1=O)=O)=O)s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9422 |
| logD: | 1.1084 |
| logSw: | -3.5085 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.048 |
| InChI Key: | KACPEBYPNQTHPN-INIZCTEOSA-N |