5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole

C12H6ClF2N3 — CID 114271734

IUPAC5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole
SMILESFc1ccc(-c2nc3c(F)c(Cl)ccc3[nH]2)nc1
InChIInChI=1S/C12H6ClF2N3/c13-7-2-4-8-11(10(7)15)18-12(17-8)9-3-1-6(14)5-16-9/h1-5H,(H,17,18)
InChIKeyLFWYFJPFJZAKPG-UHFFFAOYSA-N
MW265.65 g/mol
LogP3.56
Rot. Bonds1

About 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole

5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole (PubChem CID 114271734) has the molecular formula C12H6ClF2N3 and a molecular weight of 265.65 g/mol. Its IUPAC name is 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole.

Molecular Properties

Compound Name5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole
PubChem CID114271734
Molecular FormulaC12H6ClF2N3
Molecular Weight265.65 g/mol
Exact Mass265.02
IUPAC Name5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole
SMILESFc1ccc(-c2nc3c(F)c(Cl)ccc3[nH]2)nc1
InChIInChI=1S/C12H6ClF2N3/c13-7-2-4-8-11(10(7)15)18-12(17-8)9-3-1-6(14)5-16-9/h1-5H,(H,17,18)
InChIKeyLFWYFJPFJZAKPG-UHFFFAOYSA-N
XLogP3.56
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.65
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104639107
2-(5-fluoro-2-pyridinyl)-6-methyl-1H-benzimidazole
CID 104639104
4-(5-chloro-4-fluoro-1H-benzimidazol-2-yl)pyridin-3-ol
CID 136951446
6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol
CID 167785280
2-(5-fluoro-2-pyridinyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 104639118
5-chloro-2-(chloromethyl)-4-fluoro-1H-benzimidazole
CID 130658186
6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104639106
2-(5-chloro-2-pyridinyl)-6-fluoro-1H-benzimidazole
CID 64724542
[2-(5-fluoro-2-pyridinyl)-3H-benzimidazol-5-yl]methanamine
CID 113436420
2-(5-fluoro-2-pyridinyl)-7-methyl-1H-imidazo[4,5-b]pyridine
CID 104639110
2-(5-chloro-4-fluoro-1H-benzimidazol-2-yl)ethanamine
CID 126972905
2-(5-fluoro-2-pyridinyl)-3H-benzimidazole-5-carboxylic acid
CID 104639134

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole?
The IUPAC name of 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole (CID 114271734) is 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole.
What is the SMILES notation for 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole?
The canonical SMILES for 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole is Fc1ccc(-c2nc3c(F)c(Cl)ccc3[nH]2)nc1.
What is the InChIKey of 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole?
The InChIKey is LFWYFJPFJZAKPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6ClF2N3/c13-7-2-4-8-11(10(7)15)18-12(17-8)9-3-1-6(14)5-16-9/h1-5H,(H,17,18).
What are the key properties of 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole?
5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole has a molecular weight of 265.65 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole is sourced from PubChem (CID 114271734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).