5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole

C11H7BrN2S — CID 116884338

IUPAC5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole
SMILESBrc1ncc(-c2csc3ccccc23)[nH]1
InChIInChI=1S/C11H7BrN2S/c12-11-13-5-9(14-11)8-6-15-10-4-2-1-3-7(8)10/h1-6H,(H,13,14)
InChIKeyOZMYPZTXQHJFRJ-UHFFFAOYSA-N
MW279.16 g/mol
LogP4.05
Rot. Bonds1

About 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole

5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole (PubChem CID 116884338) has the molecular formula C11H7BrN2S and a molecular weight of 279.16 g/mol. Its IUPAC name is 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole.

Molecular Properties

Compound Name5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole
PubChem CID116884338
Molecular FormulaC11H7BrN2S
Molecular Weight279.16 g/mol
Exact Mass277.95
IUPAC Name5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole
SMILESBrc1ncc(-c2csc3ccccc23)[nH]1
InChIInChI=1S/C11H7BrN2S/c12-11-13-5-9(14-11)8-6-15-10-4-2-1-3-7(8)10/h1-6H,(H,13,14)
InChIKeyOZMYPZTXQHJFRJ-UHFFFAOYSA-N
XLogP4.05
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.16
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole 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

[1-[5-(1-benzothiophen-3-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine
CID 116882144
N-[[5-(1-benzothiophen-3-yl)-1H-imidazol-2-yl]methyl]cyclopropanamine
CID 116877405
2-bromo-5-(2-bromophenyl)-1H-imidazole
CID 117259929
3-(2-bromophenyl)-1-benzothiophene
CID 134529579
4-(1-benzothiophen-3-yl)-1H-pyrazol-5-amine
CID 68946010
5-(1-benzothiophen-3-yl)-2,3-dihydro-1H-tetrazole
CID 170201826
3-amino-5-(1-benzothiophen-3-yl)-1H-imidazole-2-thione
CID 82383751
5-(1-benzothiophen-3-yl)-N-cyclopropyl-1H-pyrazol-3-amine
CID 116827364
2-(1-benzothiophen-3-yl)-5-bromo-4-hydroxy-1H-pyrimidin-6-one
CID 66311722
5-(1-benzothiophen-3-yl)-2-methyl-1H-pyrrole-3-carbonitrile
CID 116828195
2-(1-benzothiophen-3-yl)-5-bromo-1,3-thiazol-4-amine
CID 116864381
4-(1-benzothiophen-3-yl)-2-bromo-6-methylpyrimidine
CID 116897334

Frequently Asked Questions

What is the IUPAC name of 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole?
The IUPAC name of 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole (CID 116884338) is 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole.
What is the SMILES notation for 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole?
The canonical SMILES for 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole is Brc1ncc(-c2csc3ccccc23)[nH]1.
What is the InChIKey of 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole?
The InChIKey is OZMYPZTXQHJFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrN2S/c12-11-13-5-9(14-11)8-6-15-10-4-2-1-3-7(8)10/h1-6H,(H,13,14).
What are the key properties of 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole?
5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole has a molecular weight of 279.16 g/mol, XLogP of 4.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzothiophen-3-yl)-2-bromo-1H-imidazole is sourced from PubChem (CID 116884338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).