4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine

C74H58N2 — CID 91503423

IUPAC4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine
SMILESCc1ccc(-c2cc(-c3cccc(C)c3)cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)c3)c2)cc1.Cc1cccc(-c2cc(-c3cccc(C)c3)cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)c3)c2)c1
InChIInChI=1S/2C37H29N/c1-26-11-9-17-30(19-26)32-21-33(31-18-10-12-27(2)20-31)23-34(22-32)35-24-36(28-13-5-3-6-14-28)38-37(25-35)29-15-7-4-8-16-29;1-26-16-18-28(19-17-26)32-21-33(31-15-9-10-27(2)20-31)23-34(22-32)35-24-36(29-11-5-3-6-12-29)38-37(25-35)30-13-7-4-8-14-30/h2*3-25H,1-2H3
InChIKeyGQSITSQHMVGWHB-UHFFFAOYSA-N
MW975.29 g/mol
LogP20.07
Rot. Bonds10

About 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine

4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine (PubChem CID 91503423) has the molecular formula C74H58N2 and a molecular weight of 975.29 g/mol. Its IUPAC name is 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine.

Molecular Properties

Compound Name4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine
PubChem CID91503423
Molecular FormulaC74H58N2
Molecular Weight975.29 g/mol
Exact Mass974.46
IUPAC Name4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine
SMILESCc1ccc(-c2cc(-c3cccc(C)c3)cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)c3)c2)cc1.Cc1cccc(-c2cc(-c3cccc(C)c3)cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)c3)c2)c1
InChIInChI=1S/2C37H29N/c1-26-11-9-17-30(19-26)32-21-33(31-18-10-12-27(2)20-31)23-34(22-32)35-24-36(28-13-5-3-6-14-28)38-37(25-35)29-15-7-4-8-16-29;1-26-16-18-28(19-17-26)32-21-33(31-15-9-10-27(2)20-31)23-34(22-32)35-24-36(29-11-5-3-6-12-29)38-37(25-35)30-13-7-4-8-14-30/h2*3-25H,1-2H3
InChIKeyGQSITSQHMVGWHB-UHFFFAOYSA-N
XLogP20.07
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500975.29
LogP ≤ 520.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-bis(3-methylphenyl)-4-[4-(3-phenylphenyl)phenyl]pyridine;2,6-bis(3-methylphenyl)-4-(4-phenylphenyl)pyridine;4-[4-(3,5-diphenylphenyl)phenyl]-2,6-bis(3-methylphenyl)pyridine
CID 157407374
2-(4,6-diphenyl-2-pyridinyl)-6-[3-(4-methylphenyl)phenyl]-4-phenylpyridine
CID 143267281
ethane;4-(3-methylphenyl)-2,6-diphenylpyridine
CID 144632055
2-(4-methylphenyl)-4,6-diphenylpyrimidine;4-(4-methylphenyl)-2,6-diphenylpyrimidine;2-[3-(3-methylphenyl)phenyl]-4,6-diphenylpyridine;4-[3-(3-methylphenyl)phenyl]-2,6-diphenylpyridine;2-[3-(3-methylphenyl)phenyl]-4,6-diphenylpyrimidine;4-[3-(3-methylphenyl)phenyl]-2,6-diphenylpyrimidine
CID 159145948
2-(4-methylphenyl)-4-phenyl-6-(4-phenylphenyl)pyridine
CID 12582139
bis(4-[4-[3-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-2,6-bis(4-phenylphenyl)pyridine);2-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenylpyridine;4-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-2,6-diphenylpyridine
CID 161135007
2,6-bis[2,6-dimethyl-3,5-bis(4-methylphenyl)phenyl]-4-phenylpyridine;4-[3,5-bis(4-methylphenyl)phenyl]-2,6-bis(3-methylphenyl)pyridine;2-[3,5-bis(3-methylphenyl)phenyl]-4,6-diphenylpyridine;4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3,5-bis(4-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine;2-(3-methylphenyl)-6-[3-(3-methylphenyl)phenyl]-4-phenylpyridine
CID 158723796
2,6-diphenyl-4-[3-(3-phenylphenyl)phenyl]pyridine
CID 58943255
4-methyl-2-(3-phenylphenyl)-6-(4-phenylphenyl)pyridine
CID 138661699
2,4-diphenyl-6-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]pyridine
CID 58943632
4-[3,5-bis(4-phenylphenyl)phenyl]-2,6-diphenylpyridine
CID 58943272
1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
CID 123283333

Frequently Asked Questions

What is the IUPAC name of 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine?
The IUPAC name of 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine (CID 91503423) is 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine.
What is the SMILES notation for 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine?
The canonical SMILES for 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine is Cc1ccc(-c2cc(-c3cccc(C)c3)cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)c3)c2)cc1.Cc1cccc(-c2cc(-c3cccc(C)c3)cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)c3)c2)c1.
What is the InChIKey of 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine?
The InChIKey is GQSITSQHMVGWHB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H29N/c1-26-11-9-17-30(19-26)32-21-33(31-18-10-12-27(2)20-31)23-34(22-32)35-24-36(28-13-5-3-6-14-28)38-37(25-35)29-15-7-4-8-16-29;1-26-16-18-28(19-17-26)32-21-33(31-15-9-10-27(2)20-31)23-34(22-32)35-24-36(29-11-5-3-6-12-29)38-37(25-35)30-13-7-4-8-14-30/h2*3-25H,1-2H3.
What are the key properties of 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine?
4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine has a molecular weight of 975.29 g/mol, XLogP of 20.07, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3,5-bis(3-methylphenyl)phenyl]-2,6-diphenylpyridine;4-[3-(3-methylphenyl)-5-(4-methylphenyl)phenyl]-2,6-diphenylpyridine is sourced from PubChem (CID 91503423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).