1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole

C20H15FN2O — CID 134816858

IUPAC1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole
SMILESCOc1ccc(-c2nc3ccccc3n2-c2ccc(F)cc2)cc1
InChIInChI=1S/C20H15FN2O/c1-24-17-12-6-14(7-13-17)20-22-18-4-2-3-5-19(18)23(20)16-10-8-15(21)9-11-16/h2-13H,1H3
InChIKeyDAEANAFENIDXBX-UHFFFAOYSA-N
MW318.35 g/mol
LogP4.84
Rot. Bonds3

About 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole

1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole (PubChem CID 134816858) has the molecular formula C20H15FN2O and a molecular weight of 318.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole
PubChem CID134816858
Molecular FormulaC20H15FN2O
Molecular Weight318.35 g/mol
Exact Mass318.12
IUPAC Name1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole
SMILESCOc1ccc(-c2nc3ccccc3n2-c2ccc(F)cc2)cc1
InChIInChI=1S/C20H15FN2O/c1-24-17-12-6-14(7-13-17)20-22-18-4-2-3-5-19(18)23(20)16-10-8-15(21)9-11-16/h2-13H,1H3
InChIKeyDAEANAFENIDXBX-UHFFFAOYSA-N
XLogP4.84
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole
CID 95930125
1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole
CID 19353947
1-(4-bromophenyl)-2-(4-methoxyphenyl)benzimidazole
CID 134817006
2-(4-methoxyphenyl)-1-(6-methoxy-3-pyridinyl)benzimidazole
CID 102212973
1-(4-methoxyphenyl)-2-thiophen-3-ylbenzimidazole
CID 57424026
1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)phenoxy]phenyl]benzimidazole
CID 141099436
1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
1-(4-chlorophenyl)-2-(3-methoxyphenyl)benzimidazole
CID 134816857
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
2-[4-[4,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 155186062
2-[3,5-bis[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]-1-pyridin-4-ylbenzimidazole
CID 155179345
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole?
The IUPAC name of 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole (CID 134816858) is 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole?
The canonical SMILES for 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole is COc1ccc(-c2nc3ccccc3n2-c2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole?
The InChIKey is DAEANAFENIDXBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O/c1-24-17-12-6-14(7-13-17)20-22-18-4-2-3-5-19(18)23(20)16-10-8-15(21)9-11-16/h2-13H,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole?
1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole has a molecular weight of 318.35 g/mol, XLogP of 4.84, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole is sourced from PubChem (CID 134816858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).