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

C20H15ClN2O — CID 19353947

IUPAC1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole
SMILESCOc1ccc(-c2nc3ccccc3n2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C20H15ClN2O/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
InChIKeyRCUVUYLUPUYTNG-UHFFFAOYSA-N
MW334.81 g/mol
LogP5.35
Rot. Bonds3

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

1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole (PubChem CID 19353947) has the molecular formula C20H15ClN2O and a molecular weight of 334.81 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole
PubChem CID19353947
Molecular FormulaC20H15ClN2O
Molecular Weight334.81 g/mol
Exact Mass334.09
IUPAC Name1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole
SMILESCOc1ccc(-c2nc3ccccc3n2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C20H15ClN2O/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
InChIKeyRCUVUYLUPUYTNG-UHFFFAOYSA-N
XLogP5.35
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.81
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)-2-(3-methoxyphenyl)benzimidazole
CID 134816857
1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole
CID 134816858
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-fluorophenyl)-2-(4-methylphenyl)benzimidazole
CID 95930125
1-(4-chlorophenyl)-2-(4-pyridin-4-ylphenyl)benzimidazole;(3Z)-penta-1,3-diene
CID 144527338
2-[4-[4-[2,5-bis(4-methylphenyl)pyrrol-1-yl]phenyl]phenyl]-1-phenylbenzimidazole
CID 58489476
(E)-1-[2-(4-chlorophenyl)-1-phenylbenzimidazol-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
CID 10600234
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole?
The IUPAC name of 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole (CID 19353947) is 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole.
What is the SMILES notation for 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole?
The canonical SMILES for 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole is COc1ccc(-c2nc3ccccc3n2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole?
The InChIKey is RCUVUYLUPUYTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN2O/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-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole?
1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole has a molecular weight of 334.81 g/mol, XLogP of 5.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-(4-methoxyphenyl)benzimidazole is sourced from PubChem (CID 19353947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).