2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine

C22H14Br2N2 — CID 21015495

IUPAC2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine
SMILESBrc1ccc(-c2ccc(Br)c(-c3ccccn3)c2)cc1-c1ccccn1
InChIInChI=1S/C22H14Br2N2/c23-19-9-7-15(13-17(19)21-5-1-3-11-25-21)16-8-10-20(24)18(14-16)22-6-2-4-12-26-22/h1-14H
InChIKeyQSQUAQHQCPTDRZ-UHFFFAOYSA-N
MW466.18 g/mol
LogP7.00
Rot. Bonds3

About 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine

2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine (PubChem CID 21015495) has the molecular formula C22H14Br2N2 and a molecular weight of 466.18 g/mol. Its IUPAC name is 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine
PubChem CID21015495
Molecular FormulaC22H14Br2N2
Molecular Weight466.18 g/mol
Exact Mass463.95
IUPAC Name2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine
SMILESBrc1ccc(-c2ccc(Br)c(-c3ccccn3)c2)cc1-c1ccccn1
InChIInChI=1S/C22H14Br2N2/c23-19-9-7-15(13-17(19)21-5-1-3-11-25-21)16-8-10-20(24)18(14-16)22-6-2-4-12-26-22/h1-14H
InChIKeyQSQUAQHQCPTDRZ-UHFFFAOYSA-N
XLogP7.00
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.18
LogP ≤ 57.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 6834
Zimelidine
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Dexbrompheniramine
CID 16960
2-(4-Bromophenyl)-5-pentylpyridine
CID 3092175
4,4'-Diphenyl-2,2'-bipyridine
CID 80259
3-(6-Bromonaphthalen-2-yl)pyridine
CID 11558270
2-(4-Bromophenyl)-5-butylpyridine
CID 3126214
(2E)-3-(4-Bromophenyl)-N,N-dimethyl-3-(3-pyridinyl)-2-propen-1-amine
CID 5458656
2-Phenyl-5-[(5-phenyl-3-pyridinyl)methyl]pyridine
CID 73356736
2-[(E)-2-(4-bromophenyl)ethenyl]-1-methylpyridinium
CID 5926345
(-)-Brompheniramine
CID 6328079
1-Benzyl-3-bromoquinolin-1-ium bromide
CID 24892266

Frequently Asked Questions

What is the IUPAC name of 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine?
The IUPAC name of 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine (CID 21015495) is 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine.
What is the SMILES notation for 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine?
The canonical SMILES for 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine is Brc1ccc(-c2ccc(Br)c(-c3ccccn3)c2)cc1-c1ccccn1.
What is the InChIKey of 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine?
The InChIKey is QSQUAQHQCPTDRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14Br2N2/c23-19-9-7-15(13-17(19)21-5-1-3-11-25-21)16-8-10-20(24)18(14-16)22-6-2-4-12-26-22/h1-14H.
What are the key properties of 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine?
2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine has a molecular weight of 466.18 g/mol, XLogP of 7.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-bromo-5-(4-bromo-3-pyridin-2-ylphenyl)phenyl]pyridine is sourced from PubChem (CID 21015495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).