9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole

C65H43N3 — CID 59372075

IUPAC9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3cncc(-c4ccc(-n5c6ccc(-c7ccccc7)cc6c6cc(-c7ccccc7)ccc65)cc4)c3)cc2)cc1
InChIInChI=1S/C65H43N3/c1-5-13-44(14-6-1)50-25-33-62-58(38-50)59-39-51(45-15-7-2-8-16-45)26-34-63(59)67(62)56-29-21-48(22-30-56)54-37-55(43-66-42-54)49-23-31-57(32-24-49)68-64-35-27-52(46-17-9-3-10-18-46)40-60(64)61-41-53(28-36-65(61)68)47-19-11-4-12-20-47/h1-43H
InChIKeyUDOHACWWWWVFOK-UHFFFAOYSA-N
MW866.08 g/mol
LogP17.28
Rot. Bonds8

About 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole

9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole (PubChem CID 59372075) has the molecular formula C65H43N3 and a molecular weight of 866.08 g/mol. Its IUPAC name is 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole.

Molecular Properties

Compound Name9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole
PubChem CID59372075
Molecular FormulaC65H43N3
Molecular Weight866.08 g/mol
Exact Mass865.35
IUPAC Name9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3cncc(-c4ccc(-n5c6ccc(-c7ccccc7)cc6c6cc(-c7ccccc7)ccc65)cc4)c3)cc2)cc1
InChIInChI=1S/C65H43N3/c1-5-13-44(14-6-1)50-25-33-62-58(38-50)59-39-51(45-15-7-2-8-16-45)26-34-63(59)67(62)56-29-21-48(22-30-56)54-37-55(43-66-42-54)49-23-31-57(32-24-49)68-64-35-27-52(46-17-9-3-10-18-46)40-60(64)61-41-53(28-36-65(61)68)47-19-11-4-12-20-47/h1-43H
InChIKeyUDOHACWWWWVFOK-UHFFFAOYSA-N
XLogP17.28
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500866.08
LogP ≤ 517.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-phenyl-5-[4-[5-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 59372042
9-phenyl-3-[5-(9-phenylcarbazol-3-yl)-3-pyridinyl]carbazole
CID 141339083
N,N-diphenyl-3-[6-(3-phenylphenyl)-9-[4-(5-phenyl-3-pyridinyl)phenyl]carbazol-3-yl]aniline
CID 129294355
9-[3-[5-(3-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 159084333
9-phenyl-3-(3-phenylphenyl)-6-[4-[9-phenyl-6-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 129054646
[4-[9-[4-[5-[4-[3,6-bis(4-trimethylsilylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]phenyl]-6-(4-trimethylsilylphenyl)carbazol-3-yl]phenyl]-trimethylsilane
CID 59372037
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158399670
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590322
9-[4-(3,5-diphenylphenyl)phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118231210
9-[4-[5-[4-(3-carbazol-9-ylphenyl)phenyl]-3-pyridinyl]phenyl]carbazole
CID 59372061
3,6-bis(3,6-diphenylcarbazol-9-yl)-9-phenylcarbazole
CID 170001752
3,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-3-ylphenyl)carbazole
CID 160711176

Frequently Asked Questions

What is the IUPAC name of 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole?
The IUPAC name of 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole (CID 59372075) is 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole.
What is the SMILES notation for 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole?
The canonical SMILES for 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3cncc(-c4ccc(-n5c6ccc(-c7ccccc7)cc6c6cc(-c7ccccc7)ccc65)cc4)c3)cc2)cc1.
What is the InChIKey of 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole?
The InChIKey is UDOHACWWWWVFOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H43N3/c1-5-13-44(14-6-1)50-25-33-62-58(38-50)59-39-51(45-15-7-2-8-16-45)26-34-63(59)67(62)56-29-21-48(22-30-56)54-37-55(43-66-42-54)49-23-31-57(32-24-49)68-64-35-27-52(46-17-9-3-10-18-46)40-60(64)61-41-53(28-36-65(61)68)47-19-11-4-12-20-47/h1-43H.
What are the key properties of 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole?
9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole has a molecular weight of 866.08 g/mol, XLogP of 17.28, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[5-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-3-pyridinyl]phenyl]-3,6-diphenylcarbazole is sourced from PubChem (CID 59372075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).