2-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8011-6583 |
| Compound Name: | 2-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C24 H18 N2 O3 S |
| Smiles: | CC1CCc2c(C#N)c(N3C(c4ccc(cc4C3=O)Oc3ccccc3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8823 |
| logD: | 5.8823 |
| logSw: | -5.6069 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.673 |
| InChI Key: | QQDOGGMVULZBHY-CQSZACIVSA-N |