1-[3-(2H-1,3-benzodioxol-5-yl)-N-methylprop-2-enamido]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
1-[3-(2H-1,3-benzodioxol-5-yl)-N-methylprop-2-enamido]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
1-[3-(2H-1,3-benzodioxol-5-yl)-N-methylprop-2-enamido]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C094-0500 |
| Compound Name: | 1-[3-(2H-1,3-benzodioxol-5-yl)-N-methylprop-2-enamido]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 434.53 |
| Molecular Formula: | C26 H30 N2 O4 |
| Smiles: | Cc1cccc(C)c1NC(C1(CCCCC1)N(C)C(/C=C/c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8191 |
| logD: | 4.8191 |
| logSw: | -4.5196 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.708 |
| InChI Key: | AONICGUONKRBAY-UHFFFAOYSA-N |