bis[4-(9H-carbazol-1-yl)phenyl]diazene

C36H24N4 — CID 140514298

IUPACbis[4-(9H-carbazol-1-yl)phenyl]diazene
SMILESc1ccc2c(c1)[nH]c1c(-c3ccc(/N=N/c4ccc(-c5cccc6c5[nH]c5ccccc56)cc4)cc3)cccc12
InChIInChI=1S/C36H24N4/c1-3-13-33-29(7-1)31-11-5-9-27(35(31)37-33)23-15-19-25(20-16-23)39-40-26-21-17-24(18-22-26)28-10-6-12-32-30-8-2-4-14-34(30)38-36(28)32/h1-22,37-38H/b40-39+
InChIKeyOXUUWPJFYFXJJL-XQQUEIPISA-N
MW512.62 g/mol
LogP10.70
Rot. Bonds4

About bis[4-(9H-carbazol-1-yl)phenyl]diazene

bis[4-(9H-carbazol-1-yl)phenyl]diazene (PubChem CID 140514298) has the molecular formula C36H24N4 and a molecular weight of 512.62 g/mol. Its IUPAC name is bis[4-(9H-carbazol-1-yl)phenyl]diazene.

Molecular Properties

Compound Namebis[4-(9H-carbazol-1-yl)phenyl]diazene
PubChem CID140514298
Molecular FormulaC36H24N4
Molecular Weight512.62 g/mol
Exact Mass512.20
IUPAC Namebis[4-(9H-carbazol-1-yl)phenyl]diazene
SMILESc1ccc2c(c1)[nH]c1c(-c3ccc(/N=N/c4ccc(-c5cccc6c5[nH]c5ccccc56)cc4)cc3)cccc12
InChIInChI=1S/C36H24N4/c1-3-13-33-29(7-1)31-11-5-9-27(35(31)37-33)23-15-19-25(20-16-23)39-40-26-21-17-24(18-22-26)28-10-6-12-32-30-8-2-4-14-34(30)38-36(28)32/h1-22,37-38H/b40-39+
InChIKeyOXUUWPJFYFXJJL-XQQUEIPISA-N
XLogP10.70
TPSA56.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.62
LogP ≤ 510.70
H-Bond Donors ≤ 52
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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Related Compounds

1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
1-[4-(2-bromophenyl)phenyl]-9H-carbazole
CID 175063939
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
1-[4-[1-[4-(9H-carbazol-1-yl)phenyl]-2,2-diphenylethenyl]phenyl]-9H-carbazole
CID 155666000
1-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
1-[4-[[4-(9H-carbazol-1-yl)phenyl]-diphenylmethyl]phenyl]-9H-carbazole
CID 141146048
[4-(9H-carbazol-1-yl)phenyl]-triphenylsilane
CID 141080008
diphenylphosphane;1-phenyl-9H-carbazole
CID 158040187
1-(4-prop-1-enylphenyl)-9H-carbazole
CID 175584569
1-[4-[4-(9H-carbazol-1-yl)-2-methylphenyl]-3-methylphenyl]-9H-carbazole
CID 159544666
1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 67532426
1-(3-triphenylen-2-ylphenyl)-9H-carbazole
CID 129197617

Frequently Asked Questions

What is the IUPAC name of bis[4-(9H-carbazol-1-yl)phenyl]diazene?
The IUPAC name of bis[4-(9H-carbazol-1-yl)phenyl]diazene (CID 140514298) is bis[4-(9H-carbazol-1-yl)phenyl]diazene.
What is the SMILES notation for bis[4-(9H-carbazol-1-yl)phenyl]diazene?
The canonical SMILES for bis[4-(9H-carbazol-1-yl)phenyl]diazene is c1ccc2c(c1)[nH]c1c(-c3ccc(/N=N/c4ccc(-c5cccc6c5[nH]c5ccccc56)cc4)cc3)cccc12.
What is the InChIKey of bis[4-(9H-carbazol-1-yl)phenyl]diazene?
The InChIKey is OXUUWPJFYFXJJL-XQQUEIPISA-N. The full InChI is InChI=1S/C36H24N4/c1-3-13-33-29(7-1)31-11-5-9-27(35(31)37-33)23-15-19-25(20-16-23)39-40-26-21-17-24(18-22-26)28-10-6-12-32-30-8-2-4-14-34(30)38-36(28)32/h1-22,37-38H/b40-39+.
What are the key properties of bis[4-(9H-carbazol-1-yl)phenyl]diazene?
bis[4-(9H-carbazol-1-yl)phenyl]diazene has a molecular weight of 512.62 g/mol, XLogP of 10.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[4-(9H-carbazol-1-yl)phenyl]diazene is sourced from PubChem (CID 140514298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).