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

C13H8Br2ClN3 — CID 115470480

IUPAC6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine
SMILESNc1nc2ccc(Cl)cc2n1-c1cc(Br)ccc1Br
InChIInChI=1S/C13H8Br2ClN3/c14-7-1-3-9(15)11(5-7)19-12-6-8(16)2-4-10(12)18-13(19)17/h1-6H,(H2,17,18)
InChIKeyRNDBWUGUTPGXBG-UHFFFAOYSA-N
MW401.49 g/mol
LogP4.79
Rot. Bonds1

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

6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine (PubChem CID 115470480) has the molecular formula C13H8Br2ClN3 and a molecular weight of 401.49 g/mol. Its IUPAC name is 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine.

Molecular Properties

Compound Name6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine
PubChem CID115470480
Molecular FormulaC13H8Br2ClN3
Molecular Weight401.49 g/mol
Exact Mass398.88
IUPAC Name6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine
SMILESNc1nc2ccc(Cl)cc2n1-c1cc(Br)ccc1Br
InChIInChI=1S/C13H8Br2ClN3/c14-7-1-3-9(15)11(5-7)19-12-6-8(16)2-4-10(12)18-13(19)17/h1-6H,(H2,17,18)
InChIKeyRNDBWUGUTPGXBG-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

5-bromo-1-(2-bromo-5-chlorophenyl)-6-fluorobenzimidazol-2-amine
CID 81275800
2-(2-amino-6-bromobenzimidazol-1-yl)-4-chlorobenzonitrile
CID 65345207
1-(3-bromophenyl)-6-chlorobenzimidazol-2-amine
CID 113316148
1-(2-bromo-5-methylphenyl)-5-chlorobenzimidazol-2-amine
CID 82766158
6-bromo-1-(5-bromo-2,4-difluorophenyl)benzimidazol-2-amine
CID 102854258
1-(3-bromo-4-fluorophenyl)-6-chlorobenzimidazol-2-amine
CID 104779956
6-bromo-1-(2-bromo-3-chlorophenyl)benzimidazol-2-amine
CID 103480613
1-(2-bromophenyl)-5-chlorobenzimidazol-2-amine
CID 43659474
6-chloro-1-(2-methylphenyl)benzimidazol-2-amine
CID 115470391
6-bromo-1-(2,5-dichloro-4-methylphenyl)benzimidazol-2-amine
CID 104727537
6-bromo-3-(2-bromo-5-chlorophenyl)imidazo[4,5-b]pyridin-2-amine
CID 81275226
6-bromo-1-(3-chloro-4-fluorophenyl)benzimidazol-2-amine
CID 65347263

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine?
The IUPAC name of 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine (CID 115470480) is 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine.
What is the SMILES notation for 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine?
The canonical SMILES for 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine is Nc1nc2ccc(Cl)cc2n1-c1cc(Br)ccc1Br.
What is the InChIKey of 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine?
The InChIKey is RNDBWUGUTPGXBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Br2ClN3/c14-7-1-3-9(15)11(5-7)19-12-6-8(16)2-4-10(12)18-13(19)17/h1-6H,(H2,17,18).
What are the key properties of 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine?
6-chloro-1-(2,5-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 6-chloro-1-(2,5-dibromophenyl)benzimidazol-2-amine is sourced from PubChem (CID 115470480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).