Basic information
- CAS
339230-33-0- Standard SMILES
O=C(Nc1ccc(Oc2ccc3c(c2)C(=O)OC3=O)cc1)c1ccc2c(c1)C(=O)N(c1ccc(N=Nc3ccccc3)cc1)C2=O- InChIKey
GDMKBGZBHZWAHN-UHFFFAOYSA-N- Molecular formula
- C35H20N4O7
- Average molar mass
- 608.6 g/mol
- Monoisotopic mass
- 608.13319899
Names & identifiers
- Preferred name
- N-{4-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2-{4-[(E)-phenyldiazenyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxamide
- IUPAC
- N-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]-1,3-dioxo-2-(4-phenyldiazenylphenyl)isoindole-5-carboxamide
Names & synonyms
DTXSID801038391STK662601AKOS005526101339230-33-0N-{4-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2-{4-[(E)-phenyldiazenyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxamide1H-Isoindole-5-carboxamide, N-[4-[(1,3-dihydro-1,3-dioxo-5-isobenzofuranyl)oxy]phenyl]-2,3-dihydro-1,3-dioxo-2-[4-(2-phenyldiazenyl)phenyl]-N-{4-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2-[4-(phenyldiazenyl)phenyl]-2,3-dihydro-1H-isoindole-5-carboxamide
Database identifiers
- CAS
339230-33-0- PubChem CID
- 3945447
- DTXSID
DTXSID801038391
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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