Cas no 304481-46-7 (N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide)

N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide structure
304481-46-7 structure
Product Name:N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide
CAS No:304481-46-7
MF:C22H18N4O6
MW:434.401525020599
CID:1442825
PubChem ID:135458704
Update Time:2025-04-20

N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide Chemical and Physical Properties

Names and Identifiers

    • N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide
    • ZINC02743088
    • AC1NSD95
    • SureCN13186578
    • ARONIS018027
    • MolPort-001-028-674
    • NSC727413
    • STK078563
    • AKOS000485192
    • MCULE-2455174352
    • NSC-727413
    • ZINC02743088; AC1NSD95; SureCN13186578; ARONIS018027; MolPort-001-028-674; NSC727413; STK078563; AKOS000485192; MCULE-2455174352; NSC-727413;
    • N',N''-[benzene-1,4-diyldi(E)methylylidene]bis(3,4-dihydroxybenzohydrazide)
    • N'~1~-[(E)-1-(4-{[(E)-2-(3,4-DIHYDROXYBENZOYL)HYDRAZONO]METHYL}PHENYL)METHYLIDENE]-3,4-DIHYDROXYBENZOHYDRAZIDE
    • N-[(E)-[4-[(E)-[(3,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl]methylideneamino]-3,4-dihydroxybenzamide
    • SCHEMBL13186578
    • 304481-46-7
    • SR-01000204381
    • SR-01000204381-1
    • Inchi： 1S/C22H18N4O6/c27-17-7-5-15(9-19(17)29)21(31)25-23-11-13-1-2-14(4-3-13)12-24-26-22(32)16-6-8-18(28)20(30)10-16/h1-12,27-30H,(H,25,31)(H,26,32)/b23-11+,24-12+
    • InChI Key： YIIUHSDZCIHNSR-ASIDMNOUSA-N
    • SMILES： OC1=C(C=CC(C(N/N=C/C2C=CC(/C=N/NC(C3C=CC(=C(C=3)O)O)=O)=CC=2)=O)=C1)O

Computed Properties

  • Exact Mass: 434.12274
  • Monoisotopic Mass: 434.12263431g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 6
  • Complexity: 636
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 164?2

Experimental Properties

  • PSA: 156.86

N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide Related Literature

304481-46-7 (N'-[[4-[[2-(3,4-dioxocyclohexa-1,5-diene-1-carbonyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-3,4-dihydroxybenzohydrazide) Related Products

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