6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole

C14H14N2OS — CID 113225125

IUPAC6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
SMILESCOc1ccc(-c2nc3scc(C)n3c2C)cc1
InChIInChI=1S/C14H14N2OS/c1-9-8-18-14-15-13(10(2)16(9)14)11-4-6-12(17-3)7-5-11/h4-8H,1-3H3
InChIKeyJYGIOFWVXAFRNK-UHFFFAOYSA-N
MW258.35 g/mol
LogP3.69
Rot. Bonds2

About 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole

6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole (PubChem CID 113225125) has the molecular formula C14H14N2OS and a molecular weight of 258.35 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
PubChem CID113225125
Molecular FormulaC14H14N2OS
Molecular Weight258.35 g/mol
Exact Mass258.08
IUPAC Name6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
SMILESCOc1ccc(-c2nc3scc(C)n3c2C)cc1
InChIInChI=1S/C14H14N2OS/c1-9-8-18-14-15-13(10(2)16(9)14)11-4-6-12(17-3)7-5-11/h4-8H,1-3H3
InChIKeyJYGIOFWVXAFRNK-UHFFFAOYSA-N
XLogP3.69
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole (CID 113225125) is 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole is COc1ccc(-c2nc3scc(C)n3c2C)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
The InChIKey is JYGIOFWVXAFRNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2OS/c1-9-8-18-14-15-13(10(2)16(9)14)11-4-6-12(17-3)7-5-11/h4-8H,1-3H3.
What are the key properties of 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole?
6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole has a molecular weight of 258.35 g/mol, XLogP of 3.69, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 113225125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).