2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol

C15H10N2O2S — CID 15580435

IUPAC2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol
SMILESOc1cccc(-c2cn3c(n2)sc2cc(O)ccc23)c1
InChIInChI=1S/C15H10N2O2S/c18-10-3-1-2-9(6-10)12-8-17-13-5-4-11(19)7-14(13)20-15(17)16-12/h1-8,18-19H
InChIKeyHUGQCCUAHWOOLT-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.63
Rot. Bonds1

About 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol

2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol (PubChem CID 15580435) has the molecular formula C15H10N2O2S and a molecular weight of 282.32 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol
PubChem CID15580435
Molecular FormulaC15H10N2O2S
Molecular Weight282.32 g/mol
Exact Mass282.05
IUPAC Name2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol
SMILESOc1cccc(-c2cn3c(n2)sc2cc(O)ccc23)c1
InChIInChI=1S/C15H10N2O2S/c18-10-3-1-2-9(6-10)12-8-17-13-5-4-11(19)7-14(13)20-15(17)16-12/h1-8,18-19H
InChIKeyHUGQCCUAHWOOLT-UHFFFAOYSA-N
XLogP3.63
TPSA57.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol?
The IUPAC name of 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol (CID 15580435) is 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol.
What is the SMILES notation for 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol?
The canonical SMILES for 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol is Oc1cccc(-c2cn3c(n2)sc2cc(O)ccc23)c1.
What is the InChIKey of 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol?
The InChIKey is HUGQCCUAHWOOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O2S/c18-10-3-1-2-9(6-10)12-8-17-13-5-4-11(19)7-14(13)20-15(17)16-12/h1-8,18-19H.
What are the key properties of 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol?
2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol has a molecular weight of 282.32 g/mol, XLogP of 3.63, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)imidazo[2,1-b][1,3]benzothiazol-6-ol is sourced from PubChem (CID 15580435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).