2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine

C48H32Br6N2 — CID 139186376

IUPAC2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine
SMILESBrc1ccc(Cc2cc(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)n2)cc1.Brc1ccc(Cc2cc(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)n2)cc1
InChIInChI=1S/2C24H16Br3N/c2*25-20-7-1-16(2-8-20)13-23-14-19(17-3-9-21(26)10-4-17)15-24(28-23)18-5-11-22(27)12-6-18/h2*1-12,14-15H,13H2
InChIKeyAYYRGOYZJYWQJM-UHFFFAOYSA-N
MW1116.22 g/mol
LogP16.59
Rot. Bonds8

About 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine

2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine (PubChem CID 139186376) has the molecular formula C48H32Br6N2 and a molecular weight of 1116.22 g/mol. Its IUPAC name is 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine.

Molecular Properties

Compound Name2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine
PubChem CID139186376
Molecular FormulaC48H32Br6N2
Molecular Weight1116.22 g/mol
Exact Mass1109.77
IUPAC Name2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine
SMILESBrc1ccc(Cc2cc(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)n2)cc1.Brc1ccc(Cc2cc(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)n2)cc1
InChIInChI=1S/2C24H16Br3N/c2*25-20-7-1-16(2-8-20)13-23-14-19(17-3-9-21(26)10-4-17)15-24(28-23)18-5-11-22(27)12-6-18/h2*1-12,14-15H,13H2
InChIKeyAYYRGOYZJYWQJM-UHFFFAOYSA-N
XLogP16.59
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001116.22
LogP ≤ 516.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-Bromophenyl)-2,4,6-triphenylpyridin-1-ium perchlorate
CID 12434472
2-(4-Bromophenyl)-4,6-diphenylpyridine
CID 2801866
1-Methyl-4-[4-(1-methyl-2,6-diphenylpyridin-1-ium-4-yl)butyl]-2,6-diphenylpyridin-1-ium
CID 2306810
4-(4-Bromophenyl)-2,6-diphenylpyridine
CID 633486
4,4'-Methanediylbis(2,6-diphenylpyridine)
CID 1888328
9-[(4-Bromophenyl)methyl]acridine;hydrochloride
CID 90679771
2-(4-Bromophenyl)-6-tert-butyl-4-phenylpyridine
CID 1727300
2,6-Bis(4-bromophenyl)-4-phenylpyridine
CID 1806873
6-Bromo-1-methyl-3,4-diphenylisoquinoline
CID 102264459
2-(4-Bromophenyl)-3-(4-methylphenyl)-5,7-diphenylindolizine
CID 13415490
6,6'-Biquinoxaline, 2,2',3,3'-tetrakis(4-bromophenyl)-
CID 3106569
4-(3-Bromophenyl)-2,6-diphenylpyridine
CID 3730816

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine?
The IUPAC name of 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine (CID 139186376) is 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine.
What is the SMILES notation for 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine?
The canonical SMILES for 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine is Brc1ccc(Cc2cc(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)n2)cc1.Brc1ccc(Cc2cc(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)n2)cc1.
What is the InChIKey of 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine?
The InChIKey is AYYRGOYZJYWQJM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H16Br3N/c2*25-20-7-1-16(2-8-20)13-23-14-19(17-3-9-21(26)10-4-17)15-24(28-23)18-5-11-22(27)12-6-18/h2*1-12,14-15H,13H2.
What are the key properties of 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine?
2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine has a molecular weight of 1116.22 g/mol, XLogP of 16.59, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(4-bromophenyl)-6-[(4-bromophenyl)methyl]pyridine is sourced from PubChem (CID 139186376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).