5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine

C13H8Br2ClN3 — CID 107601326

IUPAC5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine
SMILESNc1nc2cc(Cl)ccc2n1-c1c(Br)cccc1Br
InChIInChI=1S/C13H8Br2ClN3/c14-8-2-1-3-9(15)12(8)19-11-5-4-7(16)6-10(11)18-13(19)17/h1-6H,(H2,17,18)
InChIKeyQTDDLYSRMSDJQO-UHFFFAOYSA-N
MW401.49 g/mol
LogP4.79
Rot. Bonds1

About 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine

5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine (PubChem CID 107601326) has the molecular formula C13H8Br2ClN3 and a molecular weight of 401.49 g/mol. Its IUPAC name is 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine.

Molecular Properties

Compound Name5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine
PubChem CID107601326
Molecular FormulaC13H8Br2ClN3
Molecular Weight401.49 g/mol
Exact Mass398.88
IUPAC Name5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine
SMILESNc1nc2cc(Cl)ccc2n1-c1c(Br)cccc1Br
InChIInChI=1S/C13H8Br2ClN3/c14-8-2-1-3-9(15)12(8)19-11-5-4-7(16)6-10(11)18-13(19)17/h1-6H,(H2,17,18)
InChIKeyQTDDLYSRMSDJQO-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

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Related Compounds

1-(2-bromophenyl)-5-chlorobenzimidazol-2-amine
CID 43659474
5-chloro-2-(1-chloroethyl)-1-(2,6-dibromophenyl)benzimidazole
CID 107601498
6-bromo-1-(2,6-dibromophenyl)-5-fluorobenzimidazol-2-amine
CID 107601324
1-(2-bromo-5-methylphenyl)-5-chlorobenzimidazol-2-amine
CID 82766158
5-chloro-1-naphthalen-1-ylbenzimidazol-2-amine
CID 43659401
1-(2-bromo-5-chloro-4-methylphenyl)-5-chlorobenzimidazol-2-amine
CID 104724612
5-chloro-1-(5-chloro-2-fluorophenyl)benzimidazol-2-amine
CID 43659570
5-chloro-1-(2,4-dibromo-5-methoxyphenyl)benzimidazol-2-amine
CID 103415731
5-bromo-1-(2,6-difluorophenyl)benzimidazol-2-amine
CID 43661750
5-chloro-1-(3,5-dimethylphenyl)benzimidazol-2-amine
CID 43659458
5-chloro-1-(4-chloro-2-iodophenyl)benzimidazol-2-amine
CID 107637334
1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
CID 107601345

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine?
The IUPAC name of 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine (CID 107601326) is 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine.
What is the SMILES notation for 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine?
The canonical SMILES for 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine is Nc1nc2cc(Cl)ccc2n1-c1c(Br)cccc1Br.
What is the InChIKey of 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine?
The InChIKey is QTDDLYSRMSDJQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Br2ClN3/c14-8-2-1-3-9(15)12(8)19-11-5-4-7(16)6-10(11)18-13(19)17/h1-6H,(H2,17,18).
What are the key properties of 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine?
5-chloro-1-(2,6-dibromophenyl)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 5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine is sourced from PubChem (CID 107601326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).