9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole

C53H35N3 — CID 122627429

IUPAC9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole
SMILESc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccnc(-c3cccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3)c2)c1
InChIInChI=1S/C53H35N3/c1-5-25-50-45(21-1)46-22-2-6-26-51(46)55(50)43-19-11-16-39(33-43)36-13-9-14-37(31-36)41-29-30-54-49(35-41)42-18-10-15-38(32-42)40-17-12-20-44(34-40)56-52-27-7-3-23-47(52)48-24-4-8-28-53(48)56/h1-35H
InChIKeyIWCCYEQTVDGXJC-UHFFFAOYSA-N
MW713.88 g/mol
LogP13.94
Rot. Bonds6

About 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole

9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole (PubChem CID 122627429) has the molecular formula C53H35N3 and a molecular weight of 713.88 g/mol. Its IUPAC name is 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole.

Molecular Properties

Compound Name9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole
PubChem CID122627429
Molecular FormulaC53H35N3
Molecular Weight713.88 g/mol
Exact Mass713.28
IUPAC Name9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole
SMILESc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccnc(-c3cccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3)c2)c1
InChIInChI=1S/C53H35N3/c1-5-25-50-45(21-1)46-22-2-6-26-51(46)55(50)43-19-11-16-39(33-43)36-13-9-14-37(31-36)41-29-30-54-49(35-41)42-18-10-15-38(32-42)40-17-12-20-44(34-40)56-52-27-7-3-23-47(52)48-24-4-8-28-53(48)56/h1-35H
InChIKeyIWCCYEQTVDGXJC-UHFFFAOYSA-N
XLogP13.94
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500713.88
LogP ≤ 513.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]carbazole
CID 155771450
2-[4-(4-phenylphenyl)-2-pyridinyl]-9-(3-pyridin-2-ylphenyl)carbazole
CID 140825608
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 23386664
9-[3-[2-(3-carbazol-9-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 102416966
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole
CID 71277989
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole;ethane
CID 144541414
2-(3-carbazol-9-ylphenyl)-9-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]carbazole
CID 134252122
4-[3-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]-[1,3]oxazolo[4,5-b]indole
CID 140818723
9-[3-[4-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041263
5-(4-phenyl-2-pyridinyl)-7-(3-pyridin-2-ylphenyl)benzo[c]carbazole
CID 159887886
9-[3-[3-[5-[3-(3-carbazol-9-ylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]carbazole
CID 122622889
9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole
CID 58273653

Frequently Asked Questions

What is the IUPAC name of 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole?
The IUPAC name of 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole (CID 122627429) is 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole.
What is the SMILES notation for 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole?
The canonical SMILES for 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole is c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccnc(-c3cccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3)c2)c1.
What is the InChIKey of 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole?
The InChIKey is IWCCYEQTVDGXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H35N3/c1-5-25-50-45(21-1)46-22-2-6-26-51(46)55(50)43-19-11-16-39(33-43)36-13-9-14-37(31-36)41-29-30-54-49(35-41)42-18-10-15-38(32-42)40-17-12-20-44(34-40)56-52-27-7-3-23-47(52)48-24-4-8-28-53(48)56/h1-35H.
What are the key properties of 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole?
9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole has a molecular weight of 713.88 g/mol, XLogP of 13.94, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[3-[2-[3-(3-carbazol-9-ylphenyl)phenyl]-4-pyridinyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 122627429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).