methyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y502-8638 |
| Compound Name: | methyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 341.38 |
| Molecular Formula: | C18 H15 N O4 S |
| Smiles: | COC(c1c2CCCCc2sc1N1C(c2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.694 |
| logD: | 3.694 |
| logSw: | -4.1893 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.043 |
| InChI Key: | MSLVJUIISWTKFS-UHFFFAOYSA-N |