N-[4-({2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[4-({2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
N-[4-({2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K953-0292 |
| Compound Name: | N-[4-({2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 666.69 |
| Molecular Formula: | C40 H30 N2 O8 |
| Smiles: | COc1ccc(CCN2C(c3ccc(cc3C2=O)Oc2ccc(cc2)NC(C2=C(c3ccccc3)c3ccccc3C(=O)O2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.2841 |
| logD: | 6.2841 |
| logSw: | -5.6239 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.299 |
| InChI Key: | BZZOFBFGQXMUGB-UHFFFAOYSA-N |