2-(3-benzoylphenyl)-5-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(3-benzoylphenyl)-5-nitro-1H-isoindole-1,3(2H)-dione
2-(3-benzoylphenyl)-5-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 3289-8964 |
Compound Name: | 2-(3-benzoylphenyl)-5-nitro-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 372.34 |
Molecular Formula: | C21 H12 N2 O5 |
Smiles: | c1ccc(cc1)C(c1cccc(c1)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9724 |
logD: | 3.9724 |
logSw: | -4.3357 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 75.728 |
InChI Key: | PUZYABSUGQBYGV-UHFFFAOYSA-N |