methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5486-0230 |
| Compound Name: | methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C23 H24 N2 O5 S |
| Smiles: | [H]N(C(CCCCCN1C(c2ccccc2C1=O)=O)=O)c1c(C(=O)OC)c2CCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3216 |
| logD: | 0.9773 |
| logSw: | -3.7904 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.874 |
| InChI Key: | BWGBUFCATGWPED-UHFFFAOYSA-N |