4-[[[4-[2-[(4-Carboxyphenyl)methylidene]hydrazinyl]phthalazin-1-yl]hydrazinylidene]methyl]benzoic acid
Basic information
- CAS
27703-95-3- Standard SMILES
O=C(O)c1ccc(C=NNc2nnc(NN=Cc3ccc(C(=O)O)cc3)c3ccccc23)cc1- InChIKey
AWZXAGRDDUBGQH-UHFFFAOYSA-N- Molecular formula
- C24H18N6O4
- Average molar mass
- 454.4 g/mol
- Monoisotopic mass
- 454.13895308
Names & identifiers
- Preferred name
- 4-[[[4-[2-[(4-Carboxyphenyl)methylidene]hydrazinyl]phthalazin-1-yl]hydrazinylidene]methyl]benzoic acid
- IUPAC
- 4-[[[4-[2-[(4-carboxyphenyl)methylidene]hydrazinyl]phthalazin-1-yl]hydrazinylidene]methyl]benzoic acid
Names & synonyms
27703-95-3DTXSID209503914,4'-[2,3-Dihydrophthalazine-1,4-diylidenebis(hydrazine-2,1-diylidenemethanylylidene)]dibenzoic acid4,4'-{2,3-Dihydrophthalazine-1,4-diylidenebis[(hydrazine-2,1-diylidene)methanylylidene]}dibenzoic acid
Database identifiers
- CAS
27703-95-3- PubChem CID
- 266356
- DTXSID
DTXSID20950391
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 684
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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