5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole

C59H39N3 — CID 155241176

IUPAC5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole
SMILESc1ccc(-c2cccc(-c3cc(-c4ccccc4)cc(-c4ccc(-n5c6ccccc6c6cc7c8ccccc8n(-c8cccc(-c9ccccc9)c8)c7cc65)cc4)n3)c2)cc1
InChIInChI=1S/C59H39N3/c1-4-16-40(17-5-1)44-22-14-24-46(34-44)55-37-47(42-20-8-3-9-21-42)36-54(60-55)43-30-32-48(33-31-43)61-56-28-12-10-26-50(56)52-38-53-51-27-11-13-29-57(51)62(59(53)39-58(52)61)49-25-15-23-45(35-49)41-18-6-2-7-19-41/h1-39H
InChIKeyVZHMLHCTHXQGLX-UHFFFAOYSA-N
MW789.98 g/mol
LogP15.61
Rot. Bonds7

About 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole

5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole (PubChem CID 155241176) has the molecular formula C59H39N3 and a molecular weight of 789.98 g/mol. Its IUPAC name is 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole.

Molecular Properties

Compound Name5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole
PubChem CID155241176
Molecular FormulaC59H39N3
Molecular Weight789.98 g/mol
Exact Mass789.31
IUPAC Name5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole
SMILESc1ccc(-c2cccc(-c3cc(-c4ccccc4)cc(-c4ccc(-n5c6ccccc6c6cc7c8ccccc8n(-c8cccc(-c9ccccc9)c8)c7cc65)cc4)n3)c2)cc1
InChIInChI=1S/C59H39N3/c1-4-16-40(17-5-1)44-22-14-24-46(34-44)55-37-47(42-20-8-3-9-21-42)36-54(60-55)43-30-32-48(33-31-43)61-56-28-12-10-26-50(56)52-38-53-51-27-11-13-29-57(51)62(59(53)39-58(52)61)49-25-15-23-45(35-49)41-18-6-2-7-19-41/h1-39H
InChIKeyVZHMLHCTHXQGLX-UHFFFAOYSA-N
XLogP15.61
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500789.98
LogP ≤ 515.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-phenyl-5-[4-[4-phenyl-6-(4-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole
CID 155240607
9-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]carbazole
CID 58943621
2-[3-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
CID 118149380
9-[3-[4-[6-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole;methane
CID 157279504
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
2-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;2-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole;2-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-2-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 158195477
9-[4-[3-[6-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]-2-pyridinyl]phenyl]phenyl]carbazole
CID 58943592
9-[4-[4-[3-[3-[4-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole;9-[4-[4-[3-[4-[4-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole
CID 157372045
7-[4-(4-carbazol-9-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[2,3-b]carbazole
CID 134168520
7-phenyl-5-[3-[6-phenyl-4-(2-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole
CID 155240898

Frequently Asked Questions

What is the IUPAC name of 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole?
The IUPAC name of 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole (CID 155241176) is 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole.
What is the SMILES notation for 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole?
The canonical SMILES for 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole is c1ccc(-c2cccc(-c3cc(-c4ccccc4)cc(-c4ccc(-n5c6ccccc6c6cc7c8ccccc8n(-c8cccc(-c9ccccc9)c8)c7cc65)cc4)n3)c2)cc1.
What is the InChIKey of 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole?
The InChIKey is VZHMLHCTHXQGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H39N3/c1-4-16-40(17-5-1)44-22-14-24-46(34-44)55-37-47(42-20-8-3-9-21-42)36-54(60-55)43-30-32-48(33-31-43)61-56-28-12-10-26-50(56)52-38-53-51-27-11-13-29-57(51)62(59(53)39-58(52)61)49-25-15-23-45(35-49)41-18-6-2-7-19-41/h1-39H.
What are the key properties of 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole?
5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole has a molecular weight of 789.98 g/mol, XLogP of 15.61, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-phenylphenyl)-7-[4-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole is sourced from PubChem (CID 155241176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).