5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine

C9H8BrClN4 — CID 164661947

IUPAC5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine
SMILESCc1nc(-c2ncc(Br)c(Cl)n2)[nH]c1C
InChIInChI=1S/C9H8BrClN4/c1-4-5(2)14-9(13-4)8-12-3-6(10)7(11)15-8/h3H,1-2H3,(H,13,14)
InChIKeyFUZYRKBGRHMPDJ-UHFFFAOYSA-N
MW287.55 g/mol
LogP2.90
Rot. Bonds1

About 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine

5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine (PubChem CID 164661947) has the molecular formula C9H8BrClN4 and a molecular weight of 287.55 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine.

Molecular Properties

Compound Name5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine
PubChem CID164661947
Molecular FormulaC9H8BrClN4
Molecular Weight287.55 g/mol
Exact Mass285.96
IUPAC Name5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine
SMILESCc1nc(-c2ncc(Br)c(Cl)n2)[nH]c1C
InChIInChI=1S/C9H8BrClN4/c1-4-5(2)14-9(13-4)8-12-3-6(10)7(11)15-8/h3H,1-2H3,(H,13,14)
InChIKeyFUZYRKBGRHMPDJ-UHFFFAOYSA-N
XLogP2.90
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.55
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine 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

5-bromo-4-chloro-2-(3,5-dimethylphenyl)pyrimidine
CID 66312284
5-bromo-2-chloro-4-methylpyrimidine;5-bromo-2,4-dichloropyrimidine
CID 159405542
5-bromo-4-chloro-2-(1-methylpyrazol-3-yl)pyrimidine
CID 66291840
5-bromo-4-chloro-2-(1-methylimidazol-4-yl)pyrimidine
CID 130598652
5-(5-bromo-4-chloropyrimidin-2-yl)-2-methoxy-1,3-thiazole
CID 130590473
5-bromo-4-chloro-2-(4-ethoxyphenyl)pyrimidine
CID 66312090
5-bromo-4-chloro-2-fluoropyrimidine
CID 174338994
5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine
CID 103347910
5-bromo-2-(3-bromo-4-fluorophenyl)-4-chloropyrimidine
CID 82809152
5-bromo-8-chloro-2-methyl-3H-pyrido[3,4-d]pyrimidin-4-one
CID 155463570
5-bromo-4-chloro-2-ethoxypyrimidine
CID 130053493
5-bromo-4-chloro-2-(2-propylpyrazol-3-yl)pyrimidine
CID 114556697

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine?
The IUPAC name of 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine (CID 164661947) is 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine.
What is the SMILES notation for 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine?
The canonical SMILES for 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine is Cc1nc(-c2ncc(Br)c(Cl)n2)[nH]c1C.
What is the InChIKey of 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine?
The InChIKey is FUZYRKBGRHMPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrClN4/c1-4-5(2)14-9(13-4)8-12-3-6(10)7(11)15-8/h3H,1-2H3,(H,13,14).
What are the key properties of 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine?
5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine has a molecular weight of 287.55 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-(4,5-dimethyl-1H-imidazol-2-yl)pyrimidine is sourced from PubChem (CID 164661947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).