N~5~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~,N~2~-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2,5-dicarboxamide
Chemical Structure Depiction of
N~5~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~,N~2~-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2,5-dicarboxamide
N~5~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~,N~2~-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2,5-dicarboxamide
Compound characteristics
| Compound ID: | T408-1942 |
| Compound Name: | N~5~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~,N~2~-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2,5-dicarboxamide |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C20 H22 N2 O4 S |
| Smiles: | CN(C)C(c1cc2CC(CCc2s1)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1903 |
| logD: | 2.1903 |
| logSw: | -2.9323 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.707 |
| InChI Key: | IIKILJLYXWCIMM-CYBMUJFWSA-N |