4-[4-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)phenoxy]benzonitrile
Chemical Structure Depiction of
4-[4-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)phenoxy]benzonitrile
4-[4-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)phenoxy]benzonitrile
Compound characteristics
Compound ID: | 1171-0255 |
Compound Name: | 4-[4-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)phenoxy]benzonitrile |
Molecular Weight: | 432.43 |
Molecular Formula: | C27 H16 N2 O4 |
Smiles: | C(c1ccc(cc1)Oc1ccc(cc1)N1C(c2ccc(cc2C1=O)Oc1ccccc1)=O)#N |
Stereo: | ACHIRAL |
logP: | 5.8792 |
logD: | 5.8792 |
logSw: | -5.9761 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 59.432 |
InChI Key: | AQMKLXSQQHTPPR-UHFFFAOYSA-N |