2-(4-bromophenyl)-1-phenylbenzimidazole

C19H13BrN2 — CID 23094070

IUPAC2-(4-bromophenyl)-1-phenylbenzimidazole
SMILESBrc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1
InChIInChI=1S/C19H13BrN2/c20-15-12-10-14(11-13-15)19-21-17-8-4-5-9-18(17)22(19)16-6-2-1-3-7-16/h1-13H
InChIKeyDXRLALXPCIOIDK-UHFFFAOYSA-N
MW349.23 g/mol
LogP5.45
Rot. Bonds2

About 2-(4-bromophenyl)-1-phenylbenzimidazole

2-(4-bromophenyl)-1-phenylbenzimidazole (PubChem CID 23094070) has the molecular formula C19H13BrN2 and a molecular weight of 349.23 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-phenylbenzimidazole
PubChem CID23094070
Molecular FormulaC19H13BrN2
Molecular Weight349.23 g/mol
Exact Mass348.03
IUPAC Name2-(4-bromophenyl)-1-phenylbenzimidazole
SMILESBrc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1
InChIInChI=1S/C19H13BrN2/c20-15-12-10-14(11-13-15)19-21-17-8-4-5-9-18(17)22(19)16-6-2-1-3-7-16/h1-13H
InChIKeyDXRLALXPCIOIDK-UHFFFAOYSA-N
XLogP5.45
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.23
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
2-[4-[10-(4-bromophenyl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole
CID 58037722
1-(4-bromophenyl)-2-(4-methoxyphenyl)benzimidazole
CID 134817006
2-[4-[4,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 155186062
1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)phenoxy]phenyl]benzimidazole
CID 141099436
1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
3-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]quinazolin-4-one
CID 121247662
2-[4-(10-methylphenanthren-9-yl)phenyl]-1-phenylbenzimidazole
CID 166656592
1,2-diphenylbenzimidazole;ethane;iridium;propane
CID 142394497
1-phenyl-2-[4-[4-(2,3,4,5-tetraphenylpyrrol-1-yl)phenyl]phenyl]benzimidazole
CID 58489449

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-phenylbenzimidazole?
The IUPAC name of 2-(4-bromophenyl)-1-phenylbenzimidazole (CID 23094070) is 2-(4-bromophenyl)-1-phenylbenzimidazole.
What is the SMILES notation for 2-(4-bromophenyl)-1-phenylbenzimidazole?
The canonical SMILES for 2-(4-bromophenyl)-1-phenylbenzimidazole is Brc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-1-phenylbenzimidazole?
The InChIKey is DXRLALXPCIOIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrN2/c20-15-12-10-14(11-13-15)19-21-17-8-4-5-9-18(17)22(19)16-6-2-1-3-7-16/h1-13H.
What are the key properties of 2-(4-bromophenyl)-1-phenylbenzimidazole?
2-(4-bromophenyl)-1-phenylbenzimidazole has a molecular weight of 349.23 g/mol, XLogP of 5.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-phenylbenzimidazole is sourced from PubChem (CID 23094070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).