9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole

C56H36N6 — CID 165167552

IUPAC9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4cccc(-n5c6ccccc6c6ccccc65)n4)nc(-c4cccc(-n5c6ccccc6c6ccccc65)n4)c3)c2)cc1
InChIInChI=1S/C56H36N6/c1-3-17-37(18-4-1)39-33-47(38-19-5-2-6-20-38)57-48(34-39)40-35-49(45-25-15-31-55(59-45)61-51-27-11-7-21-41(51)42-22-8-12-28-52(42)61)58-50(36-40)46-26-16-32-56(60-46)62-53-29-13-9-23-43(53)44-24-10-14-30-54(44)62/h1-36H
InChIKeyXBCOYJIEZQSDFU-UHFFFAOYSA-N
MW792.95 g/mol
LogP13.80
Rot. Bonds7

About 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole

9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole (PubChem CID 165167552) has the molecular formula C56H36N6 and a molecular weight of 792.95 g/mol. Its IUPAC name is 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole.

Molecular Properties

Compound Name9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
PubChem CID165167552
Molecular FormulaC56H36N6
Molecular Weight792.95 g/mol
Exact Mass792.30
IUPAC Name9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4cccc(-n5c6ccccc6c6ccccc65)n4)nc(-c4cccc(-n5c6ccccc6c6ccccc65)n4)c3)c2)cc1
InChIInChI=1S/C56H36N6/c1-3-17-37(18-4-1)39-33-47(38-19-5-2-6-20-38)57-48(34-39)40-35-49(45-25-15-31-55(59-45)61-51-27-11-7-21-41(51)42-22-8-12-28-52(42)61)58-50(36-40)46-26-16-32-56(60-46)62-53-29-13-9-23-43(53)44-24-10-14-30-54(44)62/h1-36H
InChIKeyXBCOYJIEZQSDFU-UHFFFAOYSA-N
XLogP13.80
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500792.95
LogP ≤ 513.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole with MolForge

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Launch Full Analysis

Related Compounds

9-[6-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-phenyl-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]carbazole
CID 138513651
9-[6-[2-[4-(6-carbazol-9-yl-2-pyridinyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]-2-pyridinyl]carbazole
CID 59500751
5,7-bis[6-(3,5-diphenylphenyl)-2-pyridinyl]indolo[2,3-b]carbazole;5,7-bis[6-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole;5,7-bis[6-(4,6-diphenylpyrimidin-2-yl)-2-pyridinyl]indolo[2,3-b]carbazole;5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
CID 157405731
9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole
CID 165167516
5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
CID 58570110
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
CID 118041251
5-[6-[6-(3,5-diphenylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole
CID 59480357
9-[6-[4-carbazol-9-yl-6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-3-phenylcarbazole
CID 165167529
5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
CID 58038356
9,14-bis[6-(3,5-diphenylphenyl)-2-pyridinyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 58570081
2-[2-carbazol-9-yl-6-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-4-pyridinyl]-9-phenylcarbazole
CID 165167503
9-[6-[6-(4-phenylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole
CID 59480347

Frequently Asked Questions

What is the IUPAC name of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
The IUPAC name of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole (CID 165167552) is 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole.
What is the SMILES notation for 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
The canonical SMILES for 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4cccc(-n5c6ccccc6c6ccccc65)n4)nc(-c4cccc(-n5c6ccccc6c6ccccc65)n4)c3)c2)cc1.
What is the InChIKey of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
The InChIKey is XBCOYJIEZQSDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N6/c1-3-17-37(18-4-1)39-33-47(38-19-5-2-6-20-38)57-48(34-39)40-35-49(45-25-15-31-55(59-45)61-51-27-11-7-21-41(51)42-22-8-12-28-52(42)61)58-50(36-40)46-26-16-32-56(60-46)62-53-29-13-9-23-43(53)44-24-10-14-30-54(44)62/h1-36H.
What are the key properties of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole has a molecular weight of 792.95 g/mol, XLogP of 13.80, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole is sourced from PubChem (CID 165167552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).