phenyl-[4-(2-phenylphenyl)phenyl]diazene

C24H18N2 — CID 168866136

IUPACphenyl-[4-(2-phenylphenyl)phenyl]diazene
SMILESc1ccc(/N=N/c2ccc(-c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H18N2/c1-3-9-19(10-4-1)23-13-7-8-14-24(23)20-15-17-22(18-16-20)26-25-21-11-5-2-6-12-21/h1-18H/b26-25+
InChIKeyOJWILSUKWANSKQ-OCEACIFDSA-N
MW334.42 g/mol
LogP7.44
Rot. Bonds4

About phenyl-[4-(2-phenylphenyl)phenyl]diazene

phenyl-[4-(2-phenylphenyl)phenyl]diazene (PubChem CID 168866136) has the molecular formula C24H18N2 and a molecular weight of 334.42 g/mol. Its IUPAC name is phenyl-[4-(2-phenylphenyl)phenyl]diazene.

Molecular Properties

Compound Namephenyl-[4-(2-phenylphenyl)phenyl]diazene
PubChem CID168866136
Molecular FormulaC24H18N2
Molecular Weight334.42 g/mol
Exact Mass334.15
IUPAC Namephenyl-[4-(2-phenylphenyl)phenyl]diazene
SMILESc1ccc(/N=N/c2ccc(-c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H18N2/c1-3-9-19(10-4-1)23-13-7-8-14-24(23)20-15-17-22(18-16-20)26-25-21-11-5-2-6-12-21/h1-18H/b26-25+
InChIKeyOJWILSUKWANSKQ-OCEACIFDSA-N
XLogP7.44
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.42
LogP ≤ 57.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 phenyl-[4-(2-phenylphenyl)phenyl]diazene?
The IUPAC name of phenyl-[4-(2-phenylphenyl)phenyl]diazene (CID 168866136) is phenyl-[4-(2-phenylphenyl)phenyl]diazene.
What is the SMILES notation for phenyl-[4-(2-phenylphenyl)phenyl]diazene?
The canonical SMILES for phenyl-[4-(2-phenylphenyl)phenyl]diazene is c1ccc(/N=N/c2ccc(-c3ccccc3-c3ccccc3)cc2)cc1.
What is the InChIKey of phenyl-[4-(2-phenylphenyl)phenyl]diazene?
The InChIKey is OJWILSUKWANSKQ-OCEACIFDSA-N. The full InChI is InChI=1S/C24H18N2/c1-3-9-19(10-4-1)23-13-7-8-14-24(23)20-15-17-22(18-16-20)26-25-21-11-5-2-6-12-21/h1-18H/b26-25+.
What are the key properties of phenyl-[4-(2-phenylphenyl)phenyl]diazene?
phenyl-[4-(2-phenylphenyl)phenyl]diazene has a molecular weight of 334.42 g/mol, XLogP of 7.44, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[4-(2-phenylphenyl)phenyl]diazene is sourced from PubChem (CID 168866136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).