2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol

C15H10N2OS — CID 70499762

IUPAC2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol
SMILESOc1ccccc1-c1cnc2sc3ccccc3n12
InChIInChI=1S/C15H10N2OS/c18-13-7-3-1-5-10(13)12-9-16-15-17(12)11-6-2-4-8-14(11)19-15/h1-9,18H
InChIKeyUSVDMLTXIFRBPF-UHFFFAOYSA-N
MW266.33 g/mol
LogP3.92
Rot. Bonds1

About 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol

2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol (PubChem CID 70499762) has the molecular formula C15H10N2OS and a molecular weight of 266.33 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol
PubChem CID70499762
Molecular FormulaC15H10N2OS
Molecular Weight266.33 g/mol
Exact Mass266.05
IUPAC Name2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol
SMILESOc1ccccc1-c1cnc2sc3ccccc3n12
InChIInChI=1S/C15H10N2OS/c18-13-7-3-1-5-10(13)12-9-16-15-17(12)11-6-2-4-8-14(11)19-15/h1-9,18H
InChIKeyUSVDMLTXIFRBPF-UHFFFAOYSA-N
XLogP3.92
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol?
The IUPAC name of 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol (CID 70499762) is 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol?
The canonical SMILES for 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol is Oc1ccccc1-c1cnc2sc3ccccc3n12.
What is the InChIKey of 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol?
The InChIKey is USVDMLTXIFRBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2OS/c18-13-7-3-1-5-10(13)12-9-16-15-17(12)11-6-2-4-8-14(11)19-15/h1-9,18H.
What are the key properties of 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol?
2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol has a molecular weight of 266.33 g/mol, XLogP of 3.92, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]benzothiazol-1-ylphenol is sourced from PubChem (CID 70499762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).