6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine

C13H8Br2ClN3 — CID 103480613

IUPAC6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine
SMILESNc1nc2ccc(Br)cc2n1-c1cccc(Cl)c1Br
InChIInChI=1S/C13H8Br2ClN3/c14-7-4-5-9-11(6-7)19(13(17)18-9)10-3-1-2-8(16)12(10)15/h1-6H,(H2,17,18)
InChIKeyHXJGDPXAQSXIRW-UHFFFAOYSA-N
MW401.49 g/mol
LogP4.79
Rot. Bonds1

About 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine

6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine (PubChem CID 103480613) has the molecular formula C13H8Br2ClN3 and a molecular weight of 401.49 g/mol. Its IUPAC name is 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine.

Molecular Properties

Compound Name6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine
PubChem CID103480613
Molecular FormulaC13H8Br2ClN3
Molecular Weight401.49 g/mol
Exact Mass398.88
IUPAC Name6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine
SMILESNc1nc2ccc(Br)cc2n1-c1cccc(Cl)c1Br
InChIInChI=1S/C13H8Br2ClN3/c14-7-4-5-9-11(6-7)19(13(17)18-9)10-3-1-2-8(16)12(10)15/h1-6H,(H2,17,18)
InChIKeyHXJGDPXAQSXIRW-UHFFFAOYSA-N
XLogP4.79
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.49
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-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

6-bromo-1-(2,5-dichloro-4-methylphenyl)benzimidazol-2-amine
CID 104727537
6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine
CID 115470480
6-bromo-1-(4-bromophenyl)benzimidazol-2-amine
CID 65347115
6-bromo-1-(3-chloro-4-fluorophenyl)benzimidazol-2-amine
CID 65347263
6-bromo-1-[2-(difluoromethoxy)phenyl]benzimidazol-2-amine
CID 65347071
2-(2-amino-6-bromobenzimidazol-1-yl)-4-chlorobenzonitrile
CID 65345207
5-bromo-1-(4-bromo-2-chlorophenyl)benzimidazol-2-amine
CID 43662042
1-(3-bromophenyl)-6-chlorobenzimidazol-2-amine
CID 113316148
6-bromo-1-(5-bromo-2,4-difluorophenyl)benzimidazol-2-amine
CID 102854258
6-bromo-1-(2-bromo-4-methylphenyl)benzimidazol-2-amine
CID 65346927
6-bromo-1-(3-methoxyphenyl)benzimidazol-2-amine
CID 65347117
6-bromo-1-(3-chloro-4-methoxyphenyl)benzimidazol-2-amine
CID 65346975

Frequently Asked Questions

What is the IUPAC name of 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine?
The IUPAC name of 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine (CID 103480613) is 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine.
What is the SMILES notation for 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine?
The canonical SMILES for 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine is Nc1nc2ccc(Br)cc2n1-c1cccc(Cl)c1Br.
What is the InChIKey of 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine?
The InChIKey is HXJGDPXAQSXIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Br2ClN3/c14-7-4-5-9-11(6-7)19(13(17)18-9)10-3-1-2-8(16)12(10)15/h1-6H,(H2,17,18).
What are the key properties of 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine?
6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine has a molecular weight of 401.49 g/mol, XLogP of 4.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine is sourced from PubChem (CID 103480613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).