4-imidazo[2,1-b][1,3]thiazol-6-ylphenol

C11H8N2OS — CID 3523080

IUPAC4-imidazo[2,1-b][1,3]thiazol-6-ylphenol
SMILESOc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C11H8N2OS/c14-9-3-1-8(2-4-9)10-7-13-5-6-15-11(13)12-10/h1-7,14H
InChIKeyCUFPGQXVRGWHOQ-UHFFFAOYSA-N
MW216.27 g/mol
LogP2.77
Rot. Bonds1

About 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol

4-imidazo[2,1-b][1,3]thiazol-6-ylphenol (PubChem CID 3523080) has the molecular formula C11H8N2OS and a molecular weight of 216.27 g/mol. Its IUPAC name is 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol.

Molecular Properties

Compound Name4-imidazo[2,1-b][1,3]thiazol-6-ylphenol
PubChem CID3523080
Molecular FormulaC11H8N2OS
Molecular Weight216.27 g/mol
Exact Mass216.04
IUPAC Name4-imidazo[2,1-b][1,3]thiazol-6-ylphenol
SMILESOc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C11H8N2OS/c14-9-3-1-8(2-4-9)10-7-13-5-6-15-11(13)12-10/h1-7,14H
InChIKeyCUFPGQXVRGWHOQ-UHFFFAOYSA-N
XLogP2.77
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.27
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol?
The IUPAC name of 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol (CID 3523080) is 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol.
What is the SMILES notation for 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol?
The canonical SMILES for 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol is Oc1ccc(-c2cn3ccsc3n2)cc1.
What is the InChIKey of 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol?
The InChIKey is CUFPGQXVRGWHOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2OS/c14-9-3-1-8(2-4-9)10-7-13-5-6-15-11(13)12-10/h1-7,14H.
What are the key properties of 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol?
4-imidazo[2,1-b][1,3]thiazol-6-ylphenol has a molecular weight of 216.27 g/mol, XLogP of 2.77, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[2,1-b][1,3]thiazol-6-ylphenol is sourced from PubChem (CID 3523080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).