5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine

C13H7BrClF2N3 — CID 66086498

IUPAC5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine
SMILESNc1nc2cc(Br)c(F)cc2n1-c1cc(Cl)ccc1F
InChIInChI=1S/C13H7BrClF2N3/c14-7-4-10-12(5-9(7)17)20(13(18)19-10)11-3-6(15)1-2-8(11)16/h1-5H,(H2,18,19)
InChIKeyXRZMYZPUSCTJLX-UHFFFAOYSA-N
MW358.57 g/mol
LogP4.30
Rot. Bonds1

About 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine

5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine (PubChem CID 66086498) has the molecular formula C13H7BrClF2N3 and a molecular weight of 358.57 g/mol. Its IUPAC name is 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine.

Molecular Properties

Compound Name5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine
PubChem CID66086498
Molecular FormulaC13H7BrClF2N3
Molecular Weight358.57 g/mol
Exact Mass356.95
IUPAC Name5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine
SMILESNc1nc2cc(Br)c(F)cc2n1-c1cc(Cl)ccc1F
InChIInChI=1S/C13H7BrClF2N3/c14-7-4-10-12(5-9(7)17)20(13(18)19-10)11-3-6(15)1-2-8(11)16/h1-5H,(H2,18,19)
InChIKeyXRZMYZPUSCTJLX-UHFFFAOYSA-N
XLogP4.30
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.57
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine 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

5-bromo-1-(2-bromo-5-chlorophenyl)-6-fluorobenzimidazol-2-amine
CID 81275800
5-bromo-1-(2,5-difluorophenyl)-6-fluorobenzimidazol-2-amine
CID 66087851
5-bromo-6-fluoro-1-(2,4,5-trifluorophenyl)benzimidazol-2-amine
CID 66086895
5-chloro-1-(5-chloro-2-fluorophenyl)benzimidazol-2-amine
CID 43659570
5-bromo-6-fluoro-1-(2,4,5-trichlorophenyl)benzimidazol-2-amine
CID 66088046
5-bromo-1-(2-bromo-4-fluorophenyl)-6-fluorobenzimidazol-2-amine
CID 66086880
5-bromo-6-fluoro-1-(4-fluoro-2-iodophenyl)benzimidazol-2-amine
CID 79766831
1-(5-bromo-4-fluoro-2-methylphenyl)-5-chloro-6-fluorobenzimidazol-2-amine
CID 107593060
1-(2-bromo-4-fluorophenyl)-5-chloro-6-fluorobenzimidazol-2-amine
CID 66077914
6-bromo-1-(5-bromo-2,4-difluorophenyl)benzimidazol-2-amine
CID 102854258
6-chloro-1-(2,3,5-trifluorophenyl)benzimidazol-2-amine
CID 115470604
1-(3-bromo-4-fluorophenyl)-6-chlorobenzimidazol-2-amine
CID 104779956

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine?
The IUPAC name of 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine (CID 66086498) is 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine.
What is the SMILES notation for 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine?
The canonical SMILES for 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine is Nc1nc2cc(Br)c(F)cc2n1-c1cc(Cl)ccc1F.
What is the InChIKey of 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine?
The InChIKey is XRZMYZPUSCTJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrClF2N3/c14-7-4-10-12(5-9(7)17)20(13(18)19-10)11-3-6(15)1-2-8(11)16/h1-5H,(H2,18,19).
What are the key properties of 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine?
5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine has a molecular weight of 358.57 g/mol, XLogP of 4.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-(5-chloro-2-fluorophenyl)-6-fluorobenzimidazol-2-amine is sourced from PubChem (CID 66086498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).