dimethyl 5-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C447-0952 |
| Compound Name: | dimethyl 5-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 450.49 |
| Molecular Formula: | C25 H26 N2 O6 |
| Smiles: | COC(c1cc(cc(c1)NC(c1cccc2CN(C3CCCCC3)C(c12)=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6828 |
| logD: | 4.6818 |
| logSw: | -4.6423 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.711 |
| InChI Key: | BYDRVUUVIXSFNO-UHFFFAOYSA-N |