(4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone

C14H12N2O2S — CID 3416495

IUPAC(4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone
SMILESCOc1ccc(C(=O)c2c(C)nc3sccn23)cc1
InChIInChI=1S/C14H12N2O2S/c1-9-12(16-7-8-19-14(16)15-9)13(17)10-3-5-11(18-2)6-4-10/h3-8H,1-2H3
InChIKeyFXLGVGABIRHIAX-UHFFFAOYSA-N
MW272.33 g/mol
LogP2.94
Rot. Bonds3

About (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone

(4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone (PubChem CID 3416495) has the molecular formula C14H12N2O2S and a molecular weight of 272.33 g/mol. Its IUPAC name is (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone.

Molecular Properties

Compound Name(4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone
PubChem CID3416495
Molecular FormulaC14H12N2O2S
Molecular Weight272.33 g/mol
Exact Mass272.06
IUPAC Name(4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone
SMILESCOc1ccc(C(=O)c2c(C)nc3sccn23)cc1
InChIInChI=1S/C14H12N2O2S/c1-9-12(16-7-8-19-14(16)15-9)13(17)10-3-5-11(18-2)6-4-10/h3-8H,1-2H3
InChIKeyFXLGVGABIRHIAX-UHFFFAOYSA-N
XLogP2.94
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone?
The IUPAC name of (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone (CID 3416495) is (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone.
What is the SMILES notation for (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone?
The canonical SMILES for (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone is COc1ccc(C(=O)c2c(C)nc3sccn23)cc1.
What is the InChIKey of (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone?
The InChIKey is FXLGVGABIRHIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2S/c1-9-12(16-7-8-19-14(16)15-9)13(17)10-3-5-11(18-2)6-4-10/h3-8H,1-2H3.
What are the key properties of (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone?
(4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone has a molecular weight of 272.33 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methanone is sourced from PubChem (CID 3416495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).