9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole

C68H44N6 — CID 165167516

IUPAC9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole
SMILESc1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(-c6cc(-c7cccc(-c8ccccc8)c7)cc(-n7c8ccccc8c8ccccc87)n6)n5)n4)nc(-n4c5ccccc5c5ccccc54)c3)c2)cc1
InChIInChI=1S/C68H44N6/c1-3-19-45(20-4-1)47-23-15-25-49(39-47)51-41-61(71-67(43-51)73-63-35-11-7-27-53(63)54-28-8-12-36-64(54)73)59-33-17-31-57(69-59)58-32-18-34-60(70-58)62-42-52(50-26-16-24-48(40-50)46-21-5-2-6-22-46)44-68(72-62)74-65-37-13-9-29-55(65)56-30-10-14-38-66(56)74/h1-44H
InChIKeyWHJSFMSHPBADHO-UHFFFAOYSA-N
MW945.14 g/mol
LogP17.13
Rot. Bonds9

About 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole

9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole (PubChem CID 165167516) has the molecular formula C68H44N6 and a molecular weight of 945.14 g/mol. Its IUPAC name is 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole.

Molecular Properties

Compound Name9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole
PubChem CID165167516
Molecular FormulaC68H44N6
Molecular Weight945.14 g/mol
Exact Mass944.36
IUPAC Name9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole
SMILESc1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(-c6cc(-c7cccc(-c8ccccc8)c7)cc(-n7c8ccccc8c8ccccc87)n6)n5)n4)nc(-n4c5ccccc5c5ccccc54)c3)c2)cc1
InChIInChI=1S/C68H44N6/c1-3-19-45(20-4-1)47-23-15-25-49(39-47)51-41-61(71-67(43-51)73-63-35-11-7-27-53(63)54-28-8-12-36-64(54)73)59-33-17-31-57(69-59)58-32-18-34-60(70-58)62-42-52(50-26-16-24-48(40-50)46-21-5-2-6-22-46)44-68(72-62)74-65-37-13-9-29-55(65)56-30-10-14-38-66(56)74/h1-44H
InChIKeyWHJSFMSHPBADHO-UHFFFAOYSA-N
XLogP17.13
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms74
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500945.14
LogP ≤ 517.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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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-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
CID 165167552
5-[4-(3-phenylphenyl)phenyl]-11-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-b]carbazole
CID 121385503
2-[2-carbazol-9-yl-6-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-4-pyridinyl]-9-phenylcarbazole
CID 165167503
2-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 71286771
2-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole
CID 71286768
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-(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-[4-[3-[3-[3-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58943594
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]phenyl]carbazole
CID 58943390
9-[4-[4-[3-[3-[3-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]-5-phenylphenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole
CID 58943378
9-[3-(6-carbazol-9-yl-4-phenyl-2-pyridinyl)-5-triphenylen-2-ylphenyl]carbazole
CID 139500953

Frequently Asked Questions

What is the IUPAC name of 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole?
The IUPAC name of 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) is 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole.
What is the SMILES notation for 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole?
The canonical SMILES for 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole is c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccc(-c6cc(-c7cccc(-c8ccccc8)c7)cc(-n7c8ccccc8c8ccccc87)n6)n5)n4)nc(-n4c5ccccc5c5ccccc54)c3)c2)cc1.
What is the InChIKey of 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole?
The InChIKey is WHJSFMSHPBADHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H44N6/c1-3-19-45(20-4-1)47-23-15-25-49(39-47)51-41-61(71-67(43-51)73-63-35-11-7-27-53(63)54-28-8-12-36-64(54)73)59-33-17-31-57(69-59)58-32-18-34-60(70-58)62-42-52(50-26-16-24-48(40-50)46-21-5-2-6-22-46)44-68(72-62)74-65-37-13-9-29-55(65)56-30-10-14-38-66(56)74/h1-44H.
What are the key properties of 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole?
9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole has a molecular weight of 945.14 g/mol, XLogP of 17.13, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[6-[6-[6-carbazol-9-yl-4-(3-phenylphenyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-4-(3-phenylphenyl)-2-pyridinyl]carbazole is sourced from PubChem (CID 165167516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).