3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole

C57H37N3 — CID 71286800

IUPAC3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cccc7ccccc67)cc5)ccc43)c2)cc1
InChIInChI=1S/C57H37N3/c1-3-14-38(15-4-1)44-36-52(41-17-5-2-6-18-41)58-57(37-44)60-54-25-12-10-22-49(54)51-35-43(29-33-56(51)60)42-28-32-55-50(34-42)48-21-9-11-24-53(48)59(55)45-30-26-40(27-31-45)47-23-13-19-39-16-7-8-20-46(39)47/h1-37H
InChIKeyIKOPYRIFPBZLKS-UHFFFAOYSA-N
MW763.94 g/mol
LogP15.10
Rot. Bonds6

About 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole

3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole (PubChem CID 71286800) has the molecular formula C57H37N3 and a molecular weight of 763.94 g/mol. Its IUPAC name is 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole.

Molecular Properties

Compound Name3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole
PubChem CID71286800
Molecular FormulaC57H37N3
Molecular Weight763.94 g/mol
Exact Mass763.30
IUPAC Name3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cccc7ccccc67)cc5)ccc43)c2)cc1
InChIInChI=1S/C57H37N3/c1-3-14-38(15-4-1)44-36-52(41-17-5-2-6-18-41)58-57(37-44)60-54-25-12-10-22-49(54)51-35-43(29-33-56(51)60)42-28-32-55-50(34-42)48-21-9-11-24-53(48)59(55)45-30-26-40(27-31-45)47-23-13-19-39-16-7-8-20-46(39)47/h1-37H
InChIKeyIKOPYRIFPBZLKS-UHFFFAOYSA-N
XLogP15.10
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500763.94
LogP ≤ 515.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[4-(3-phenylphenyl)phenyl]-11-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-b]carbazole
CID 121385503
2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole;2-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 158322806
2-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 71286771
3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole
CID 164983675
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 167712900
2-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole
CID 71287046
2-bromo-4,6-diphenylpyridine;2-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;hydrofluoride
CID 159095754
3-[9-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)-6-phenylcarbazole
CID 88866629
3,9-bis(4-naphthalen-1-ylphenyl)carbazole;3-(4-naphthalen-1-ylphenyl)-9-(3-phenylphenyl)carbazole
CID 157309871
3-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 71286913
3-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158169511
3-[9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole
CID 71287137

Frequently Asked Questions

What is the IUPAC name of 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole?
The IUPAC name of 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole (CID 71286800) is 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole.
What is the SMILES notation for 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole?
The canonical SMILES for 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cccc7ccccc67)cc5)ccc43)c2)cc1.
What is the InChIKey of 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole?
The InChIKey is IKOPYRIFPBZLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H37N3/c1-3-14-38(15-4-1)44-36-52(41-17-5-2-6-18-41)58-57(37-44)60-54-25-12-10-22-49(54)51-35-43(29-33-56(51)60)42-28-32-55-50(34-42)48-21-9-11-24-53(48)59(55)45-30-26-40(27-31-45)47-23-13-19-39-16-7-8-20-46(39)47/h1-37H.
What are the key properties of 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole?
3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole has a molecular weight of 763.94 g/mol, XLogP of 15.10, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-naphthalen-1-ylphenyl)carbazole is sourced from PubChem (CID 71286800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).