6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole

C13H11ClN2S — CID 113225131

IUPAC6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
SMILESCc1csc2nc(-c3cccc(Cl)c3)c(C)n12
InChIInChI=1S/C13H11ClN2S/c1-8-7-17-13-15-12(9(2)16(8)13)10-4-3-5-11(14)6-10/h3-7H,1-2H3
InChIKeyTYMRFUIYIXVEJR-UHFFFAOYSA-N
MW262.76 g/mol
LogP4.33
Rot. Bonds1

About 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole

6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole (PubChem CID 113225131) has the molecular formula C13H11ClN2S and a molecular weight of 262.76 g/mol. Its IUPAC name is 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
PubChem CID113225131
Molecular FormulaC13H11ClN2S
Molecular Weight262.76 g/mol
Exact Mass262.03
IUPAC Name6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
SMILESCc1csc2nc(-c3cccc(Cl)c3)c(C)n12
InChIInChI=1S/C13H11ClN2S/c1-8-7-17-13-15-12(9(2)16(8)13)10-4-3-5-11(14)6-10/h3-7H,1-2H3
InChIKeyTYMRFUIYIXVEJR-UHFFFAOYSA-N
XLogP4.33
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.76
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole (CID 113225131) is 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole is Cc1csc2nc(-c3cccc(Cl)c3)c(C)n12.
What is the InChIKey of 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
The InChIKey is TYMRFUIYIXVEJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2S/c1-8-7-17-13-15-12(9(2)16(8)13)10-4-3-5-11(14)6-10/h3-7H,1-2H3.
What are the key properties of 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole has a molecular weight of 262.76 g/mol, XLogP of 4.33, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chlorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 113225131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).