palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)

C22H18N6O4Pd — CID 135492910

IUPACpalladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)
SMILESOc1ccc(/N=N/c2ccccn2)c(O)c1.Oc1ccc(/N=N/c2ccccn2)c(O)c1.[Pd]
InChIInChI=1S/2C11H9N3O2.Pd/c2*15-8-4-5-9(10(16)7-8)13-14-11-3-1-2-6-12-11;/h2*1-7,15-16H;/b2*14-13+;
InChIKeyJRLKXQNVINLHGI-FZHLCEHXSA-N
MW536.84 g/mol
LogP5.81
Rot. Bonds4

About palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)

palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol) (PubChem CID 135492910) has the molecular formula C22H18N6O4Pd and a molecular weight of 536.84 g/mol. Its IUPAC name is palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol).

Molecular Properties

Compound Namepalladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)
PubChem CID135492910
Molecular FormulaC22H18N6O4Pd
Molecular Weight536.84 g/mol
Exact Mass536.04
IUPAC Namepalladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)
SMILESOc1ccc(/N=N/c2ccccn2)c(O)c1.Oc1ccc(/N=N/c2ccccn2)c(O)c1.[Pd]
InChIInChI=1S/2C11H9N3O2.Pd/c2*15-8-4-5-9(10(16)7-8)13-14-11-3-1-2-6-12-11;/h2*1-7,15-16H;/b2*14-13+;
InChIKeyJRLKXQNVINLHGI-FZHLCEHXSA-N
XLogP5.81
TPSA156.14 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.84
LogP ≤ 55.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)?
The IUPAC name of palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol) (CID 135492910) is palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol).
What is the SMILES notation for palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)?
The canonical SMILES for palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol) is Oc1ccc(/N=N/c2ccccn2)c(O)c1.Oc1ccc(/N=N/c2ccccn2)c(O)c1.[Pd].
What is the InChIKey of palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)?
The InChIKey is JRLKXQNVINLHGI-FZHLCEHXSA-N. The full InChI is InChI=1S/2C11H9N3O2.Pd/c2*15-8-4-5-9(10(16)7-8)13-14-11-3-1-2-6-12-11;/h2*1-7,15-16H;/b2*14-13+;.
What are the key properties of palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol)?
palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol) has a molecular weight of 536.84 g/mol, XLogP of 5.81, 4 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for palladium;bis(4-(pyridin-2-yldiazenyl)benzene-1,3-diol) is sourced from PubChem (CID 135492910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).