2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide
2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide
Compound characteristics
| Compound ID: | K786-2445 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C25 H28 N2 O4 |
| Smiles: | CC1CCCC(C1C)NC(C1c2ccccc2C(N1Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6685 |
| logD: | 3.6685 |
| logSw: | -3.8344 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.933 |
| InChI Key: | LAICCICMJWDRBJ-UHFFFAOYSA-N |