4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine

C64H44N2 — CID 153434672

IUPAC4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
SMILESc1ccc(-c2cccc(-c3ccnc(-c4ccc(-c5ccccc5-c5cccc(-c6ccccc6-c6ccc(-c7cc(-c8cccc(-c9ccccc9)c8)ccn7)cc6)c5)cc4)c3)c2)cc1
InChIInChI=1S/C64H44N2/c1-3-14-45(15-4-1)51-18-11-20-53(40-51)55-36-38-65-63(43-55)49-32-28-47(29-33-49)59-24-7-9-26-61(59)57-22-13-23-58(42-57)62-27-10-8-25-60(62)48-30-34-50(35-31-48)64-44-56(37-39-66-64)54-21-12-19-52(41-54)46-16-5-2-6-17-46/h1-44H
InChIKeyDZSRKZSSNUMICB-UHFFFAOYSA-N
MW841.07 g/mol
LogP17.15
Rot. Bonds10

About 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine

4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine (PubChem CID 153434672) has the molecular formula C64H44N2 and a molecular weight of 841.07 g/mol. Its IUPAC name is 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine.

Molecular Properties

Compound Name4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
PubChem CID153434672
Molecular FormulaC64H44N2
Molecular Weight841.07 g/mol
Exact Mass840.35
IUPAC Name4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
SMILESc1ccc(-c2cccc(-c3ccnc(-c4ccc(-c5ccccc5-c5cccc(-c6ccccc6-c6ccc(-c7cc(-c8cccc(-c9ccccc9)c8)ccn7)cc6)c5)cc4)c3)c2)cc1
InChIInChI=1S/C64H44N2/c1-3-14-45(15-4-1)51-18-11-20-53(40-51)55-36-38-65-63(43-55)49-32-28-47(29-33-49)59-24-7-9-26-61(59)57-22-13-23-58(42-57)62-27-10-8-25-60(62)48-30-34-50(35-31-48)64-44-56(37-39-66-64)54-21-12-19-52(41-54)46-16-5-2-6-17-46/h1-44H
InChIKeyDZSRKZSSNUMICB-UHFFFAOYSA-N
XLogP17.15
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500841.07
LogP ≤ 517.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-2-(3-phenylphenyl)pyridine
CID 58028222
2-[4-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]-5-phenylphenyl]-3-(4-phenylphenyl)phenyl]-4-phenylpyridine
CID 148872624
2-[4-[2-[3,5-bis[2-[4-(1-methylimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-4-(4-phenylphenyl)pyridine
CID 153458259
2-[4-[2-[3,5-bis[2-[4-(6-phenyl-2-pyridinyl)phenyl]ethyl]phenyl]phenyl]phenyl]-4-(4-phenylphenyl)pyridine
CID 165148975
2-phenyl-4-[12-(2-phenyl-4-pyridinyl)triphenylen-1-yl]pyridine
CID 88951343
2-[2-[2-chloro-3-[2-[2-chloro-3-[2-(4-phenyl-2-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4-phenylpyridine
CID 176737824
2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine
CID 140599873
2-[4-[2-[3,5-bis(2-phenylphenyl)phenyl]phenyl]phenyl]-4-dibenzothiophen-3-ylpyridine
CID 167362982
4-(2-methylphenyl)-2-phenylpyridine
CID 58435073
osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)
CID 159449942
2-[3-(2-phenylphenyl)phenyl]pyridine
CID 59403973
2-naphthalen-1-yl-4-[3-[4-(4-phenylnaphthalen-1-yl)naphthalen-1-yl]phenyl]pyridine
CID 163947785

Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine?
The IUPAC name of 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine (CID 153434672) is 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine.
What is the SMILES notation for 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine?
The canonical SMILES for 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine is c1ccc(-c2cccc(-c3ccnc(-c4ccc(-c5ccccc5-c5cccc(-c6ccccc6-c6ccc(-c7cc(-c8cccc(-c9ccccc9)c8)ccn7)cc6)c5)cc4)c3)c2)cc1.
What is the InChIKey of 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine?
The InChIKey is DZSRKZSSNUMICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H44N2/c1-3-14-45(15-4-1)51-18-11-20-53(40-51)55-36-38-65-63(43-55)49-32-28-47(29-33-49)59-24-7-9-26-61(59)57-22-13-23-58(42-57)62-27-10-8-25-60(62)48-30-34-50(35-31-48)64-44-56(37-39-66-64)54-21-12-19-52(41-54)46-16-5-2-6-17-46/h1-44H.
What are the key properties of 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine?
4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine has a molecular weight of 841.07 g/mol, XLogP of 17.15, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine is sourced from PubChem (CID 153434672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).