6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole

C9H11ClN2S — CID 126691238

IUPAC6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole
SMILESCC(C)(C)c1cn2cc(Cl)sc2n1
InChIInChI=1S/C9H11ClN2S/c1-9(2,3)6-4-12-5-7(10)13-8(12)11-6/h4-5H,1-3H3
InChIKeyARSMOLYZAIDHLM-UHFFFAOYSA-N
MW214.72 g/mol
LogP3.35
Rot. Bonds

About 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole

6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole (PubChem CID 126691238) has the molecular formula C9H11ClN2S and a molecular weight of 214.72 g/mol. Its IUPAC name is 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole
PubChem CID126691238
Molecular FormulaC9H11ClN2S
Molecular Weight214.72 g/mol
Exact Mass214.03
IUPAC Name6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole
SMILESCC(C)(C)c1cn2cc(Cl)sc2n1
InChIInChI=1S/C9H11ClN2S/c1-9(2,3)6-4-12-5-7(10)13-8(12)11-6/h4-5H,1-3H3
InChIKeyARSMOLYZAIDHLM-UHFFFAOYSA-N
XLogP3.35
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.72
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-6-methylimidazo[2,1-b][1,3]thiazole
CID 24822764
(2-chloroimidazo[2,1-b][1,3]thiazol-6-yl)methanol
CID 139890406
4-(2-tert-butyl-8-methylimidazo[1,2-a]pyridin-6-yl)benzoic acid
CID 93211518
2-(4-tert-butyl-6-chloropyrimidin-2-yl)-5-chloro-1,3-thiazole
CID 107124671
6,8-ditert-butyl-[1,2,4]triazolo[4,3-a]pyrazine
CID 167341893
6,8-ditert-butylimidazo[1,2-a]pyrazine
CID 139576322
2-tert-butylimidazo[1,2-a]pyrimidine;2,2-dimethylpropane
CID 158552648
N'-tert-butyl-N-(6-tert-butylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)ethane-1,2-diamine
CID 133287378
2-ethyl-6-methylimidazo[2,1-b][1,3]thiazole
CID 15062070
2-tert-butylimidazo[1,2-a]pyrazine-8-carboxylic acid
CID 63260372
6-tert-butyl-N-(2-ethoxyethyl)imidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 47054436
4-tert-butyl-2-chloro-5-methoxypyrimidine
CID 151911521

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole (CID 126691238) is 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole is CC(C)(C)c1cn2cc(Cl)sc2n1.
What is the InChIKey of 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole?
The InChIKey is ARSMOLYZAIDHLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2S/c1-9(2,3)6-4-12-5-7(10)13-8(12)11-6/h4-5H,1-3H3.
What are the key properties of 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole?
6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole has a molecular weight of 214.72 g/mol, XLogP of 3.35, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2-chloroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 126691238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).