3,4,5-Trihydroxybenzoic acid 2-[(2,3-dimethoxyphenyl)methylene]hydrazide

HCID 4440486

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Basic information

CAS: 519147-17-2
Standard SMILES: COc1cccc(C=NNC(=O)c2cc(O)c(O)c(O)c2)c1OC
InChIKey: ZMOMANYULUNKDZ-UHFFFAOYSA-N
Molecular formula: C16H16N2O6
Average molar mass: 332.31 g/mol
Monoisotopic mass: 332.10083623

Names & identifiers

Preferred name: 3,4,5-Trihydroxybenzoic acid 2-[(2,3-dimethoxyphenyl)methylene]hydrazide
IUPAC: N-[(2,3-dimethoxyphenyl)methylideneamino]-3,4,5-trihydroxybenzamide

Names & synonyms

SCHEMBL12387981DTXSID3011499873,4,5-Trihydroxybenzoic acid 2-[(2,3-dimethoxyphenyl)methylene]hydrazide519147-17-2N'-[(2,3-Dimethoxyphenyl)methylidene]-3,4,5-trihydroxybenzohydrazide

Database identifiers

CAS: 519147-17-2
PubChem CID: 4440486
DTXSID: DTXSID301149987

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 121 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 7
Rotatable bonds: 5
Heavy atoms: 24
Formal charge: 0
Complexity: 434

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