5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole

C11H5BrCl2N2S — CID 134114479

IUPAC5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole
SMILESClc1ccc(-c2nc3sccn3c2Br)cc1Cl
InChIInChI=1S/C11H5BrCl2N2S/c12-10-9(15-11-16(10)3-4-17-11)6-1-2-7(13)8(14)5-6/h1-5H
InChIKeyBVRNUQCBHITJSG-UHFFFAOYSA-N
MW348.05 g/mol
LogP5.13
Rot. Bonds1

About 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole

5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole (PubChem CID 134114479) has the molecular formula C11H5BrCl2N2S and a molecular weight of 348.05 g/mol. Its IUPAC name is 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole
PubChem CID134114479
Molecular FormulaC11H5BrCl2N2S
Molecular Weight348.05 g/mol
Exact Mass345.87
IUPAC Name5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole
SMILESClc1ccc(-c2nc3sccn3c2Br)cc1Cl
InChIInChI=1S/C11H5BrCl2N2S/c12-10-9(15-11-16(10)3-4-17-11)6-1-2-7(13)8(14)5-6/h1-5H
InChIKeyBVRNUQCBHITJSG-UHFFFAOYSA-N
XLogP5.13
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.05
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-6-pyridin-3-ylimidazo[2,1-b][1,3]thiazole
CID 50878457
5-bromo-4-(3,4-dichlorophenyl)-1-methylimidazol-2-amine
CID 84604378
6-(4-chlorophenyl)-5-[2-(3,4-dichlorophenyl)ethoxymethyl]imidazo[2,1-b][1,3]thiazole
CID 142505454
2-(3-bromo-4-chlorophenyl)-N-[[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 142505498
N-[[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-(3,4-dichlorophenyl)ethanamine;hydrochloride
CID 155269225
N-[[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-(3,4-dichlorophenyl)-N-methylethanamine
CID 142505488
6-(4-bromophenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 712406
5-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]-3-[(3,4-dichlorophenyl)methyl]-1,2,4-oxadiazole
CID 155254974
6-(4-methylphenyl)-5-[[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]imidazo[2,1-b][1,3]thiazole
CID 132581539
6-naphthalen-2-ylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 3747079
[6-(2,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 46224395
N-[(3,4-dichlorophenyl)methoxy]-1-[6-[4-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazol-5-yl]methanimine
CID 155269219

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole (CID 134114479) is 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole is Clc1ccc(-c2nc3sccn3c2Br)cc1Cl.
What is the InChIKey of 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole?
The InChIKey is BVRNUQCBHITJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5BrCl2N2S/c12-10-9(15-11-16(10)3-4-17-11)6-1-2-7(13)8(14)5-6/h1-5H.
What are the key properties of 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole?
5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole has a molecular weight of 348.05 g/mol, XLogP of 5.13, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(3,4-dichlorophenyl)imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 134114479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).