1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine

C14H10Br2FN3O — CID 107601345

IUPAC1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
SMILESCOc1cc2c(cc1F)nc(N)n2-c1c(Br)cccc1Br
InChIInChI=1S/C14H10Br2FN3O/c1-21-12-6-11-10(5-9(12)17)19-14(18)20(11)13-7(15)3-2-4-8(13)16/h2-6H,1H3,(H2,18,19)
InChIKeyRHLWKNLCHZHMKU-UHFFFAOYSA-N
MW415.06 g/mol
LogP4.28
Rot. Bonds2

About 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine

1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine (PubChem CID 107601345) has the molecular formula C14H10Br2FN3O and a molecular weight of 415.06 g/mol. Its IUPAC name is 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine.

Molecular Properties

Compound Name1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
PubChem CID107601345
Molecular FormulaC14H10Br2FN3O
Molecular Weight415.06 g/mol
Exact Mass412.92
IUPAC Name1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
SMILESCOc1cc2c(cc1F)nc(N)n2-c1c(Br)cccc1Br
InChIInChI=1S/C14H10Br2FN3O/c1-21-12-6-11-10(5-9(12)17)19-14(18)20(11)13-7(15)3-2-4-8(13)16/h2-6H,1H3,(H2,18,19)
InChIKeyRHLWKNLCHZHMKU-UHFFFAOYSA-N
XLogP4.28
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.06
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-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-(2,6-dibromophenyl)-5-fluorobenzimidazol-2-amine
CID 107601324
1-(4-bromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
CID 63599811
1-(4-bromo-2-fluorophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
CID 63598230
1-(4-bromo-2-chlorophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
CID 63598406
1-(3,4-dimethylphenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
CID 63599291
1-(2-bromophenyl)-5,6-dimethoxybenzimidazol-2-amine
CID 83003226
5-fluoro-1-(2-fluoro-4-methylphenyl)-6-methoxybenzimidazol-2-amine
CID 63597352
1-(2,5-dichlorophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine
CID 63598050
1-(2-fluorophenyl)-5,6-dimethoxybenzimidazol-2-amine
CID 83003060
5-fluoro-1-(4-fluoro-2-iodophenyl)-6-methoxybenzimidazol-2-amine
CID 79761482
5-bromo-1-(4-bromo-3-methoxyphenyl)-6-fluorobenzimidazol-2-amine
CID 82859589
5-chloro-1-(2,6-dibromophenyl)benzimidazol-2-amine
CID 107601326

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine?
The IUPAC name of 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine (CID 107601345) is 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine.
What is the SMILES notation for 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine?
The canonical SMILES for 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine is COc1cc2c(cc1F)nc(N)n2-c1c(Br)cccc1Br.
What is the InChIKey of 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine?
The InChIKey is RHLWKNLCHZHMKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2FN3O/c1-21-12-6-11-10(5-9(12)17)19-14(18)20(11)13-7(15)3-2-4-8(13)16/h2-6H,1H3,(H2,18,19).
What are the key properties of 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine?
1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine has a molecular weight of 415.06 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dibromophenyl)-5-fluoro-6-methoxybenzimidazol-2-amine is sourced from PubChem (CID 107601345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).