2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole

C10H8BrClN2O — CID 116884290

IUPAC2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole
SMILESCOc1ccc(-c2cnc(Br)[nH]2)c(Cl)c1
InChIInChI=1S/C10H8BrClN2O/c1-15-6-2-3-7(8(12)4-6)9-5-13-10(11)14-9/h2-5H,1H3,(H,13,14)
InChIKeyWDTBZOIPUKFYPK-UHFFFAOYSA-N
MW287.54 g/mol
LogP3.50
Rot. Bonds2

About 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole

2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole (PubChem CID 116884290) has the molecular formula C10H8BrClN2O and a molecular weight of 287.54 g/mol. Its IUPAC name is 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole
PubChem CID116884290
Molecular FormulaC10H8BrClN2O
Molecular Weight287.54 g/mol
Exact Mass285.95
IUPAC Name2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole
SMILESCOc1ccc(-c2cnc(Br)[nH]2)c(Cl)c1
InChIInChI=1S/C10H8BrClN2O/c1-15-6-2-3-7(8(12)4-6)9-5-13-10(11)14-9/h2-5H,1H3,(H,13,14)
InChIKeyWDTBZOIPUKFYPK-UHFFFAOYSA-N
XLogP3.50
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.54
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(2-chloro-4-methoxyphenyl)-1H-imidazol-2-yl]hydrazine
CID 116884142
methyl 5-(2-chloro-4-methoxyphenyl)-1H-imidazole-2-carboxylate
CID 116880369
2-[5-(2-chloro-4-methoxyphenyl)-1H-imidazol-2-yl]acetonitrile
CID 116880039
5-(2,4-dichlorophenyl)-2-[(4-methoxyphenyl)methyl]-1H-imidazole
CID 18755567
2-bromo-5-(2-methoxy-4,5-dimethylphenyl)-1H-imidazole
CID 116884250
2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole
CID 116884225
4-(2-chloro-4-methoxyphenyl)-1,3-thiazole
CID 4998959
2-chloro-5-(2-chloro-4-methoxyphenyl)-4-methylpyrimidine
CID 170925653
1,3,5-trichloro-2-(2-chloro-4-methoxyphenyl)benzene
CID 134628384
5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine
CID 82287443
2-[5-bromo-4-(2-chloro-4-methoxyphenyl)-1H-imidazol-2-yl]ethanol
CID 84609241
1,3-dichloro-2-(2-chloro-4-methoxyphenyl)benzene
CID 119018458

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole?
The IUPAC name of 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole (CID 116884290) is 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole.
What is the SMILES notation for 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole?
The canonical SMILES for 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole is COc1ccc(-c2cnc(Br)[nH]2)c(Cl)c1.
What is the InChIKey of 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole?
The InChIKey is WDTBZOIPUKFYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrClN2O/c1-15-6-2-3-7(8(12)4-6)9-5-13-10(11)14-9/h2-5H,1H3,(H,13,14).
What are the key properties of 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole?
2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole has a molecular weight of 287.54 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole is sourced from PubChem (CID 116884290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).