2-[(2Z)-2-[[(2-carboxyphenyl)diazenyl]-quinolin-4-ylmethylidene]hydrazinyl]benzoic acid

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Basic information

CAS: 61854-47-5
Standard SMILES: O=C(O)c1ccccc1N=N/C(=N\Nc1ccccc1C(=O)O)c1ccnc2ccccc12
InChIKey: IUTMHRDDOZEMKA-UUCJHIDYSA-N
Molecular formula: C24H17N5O4
Average molar mass: 439.4 g/mol
Monoisotopic mass: 439.12805404

Names & identifiers

Preferred name: 2-[(2Z)-2-[[(2-carboxyphenyl)diazenyl]-quinolin-4-ylmethylidene]hydrazinyl]benzoic acid
IUPAC: 2-[(2Z)-2-[[(2-carboxyphenyl)diazenyl]-quinolin-4-ylmethylidene]hydrazinyl]benzoic acid

Names & synonyms

NSC29214261854-47-5DTXSID30421305NSC-2921422-[(2Z)-2-[[(E)-(2-carboxyphenyl)azo]-(4-quinolyl)methylene]hydrazino]benzoic acid2-{(2Z)-2-[[(E)-(2-Carboxyphenyl)diazenyl](quinolin-4-yl)methylene]hydrazino}benzoic acid2-[(2Z)-2-{[(E)-(2-Carboxyphenyl)diazenyl](quinolin-4-yl)methylidene}hydrazin-1-yl]benzoic acid

Database identifiers

CAS: 61854-47-5
PubChem CID: 5892136
DTXSID: DTXSID30421305

Properties

Computed structural properties

XLogP: 5.6
Topological polar surface area: 137 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 8
Rotatable bonds: 7
Heavy atoms: 33
Formal charge: 0
Complexity: 757

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Compound notes

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