2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol

C12H8N2O2S — CID 136927565

IUPAC2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol
SMILESOc1ccc(O)c(-c2nc3cccnc3s2)c1
InChIInChI=1S/C12H8N2O2S/c15-7-3-4-10(16)8(6-7)11-14-9-2-1-5-13-12(9)17-11/h1-6,15-16H
InChIKeyRFTDCTGTJAWGEJ-UHFFFAOYSA-N
MW244.28 g/mol
LogP2.77
Rot. Bonds1

About 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol

2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol (PubChem CID 136927565) has the molecular formula C12H8N2O2S and a molecular weight of 244.28 g/mol. Its IUPAC name is 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol.

Molecular Properties

Compound Name2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol
PubChem CID136927565
Molecular FormulaC12H8N2O2S
Molecular Weight244.28 g/mol
Exact Mass244.03
IUPAC Name2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol
SMILESOc1ccc(O)c(-c2nc3cccnc3s2)c1
InChIInChI=1S/C12H8N2O2S/c15-7-3-4-10(16)8(6-7)11-14-9-2-1-5-13-12(9)17-11/h1-6,15-16H
InChIKeyRFTDCTGTJAWGEJ-UHFFFAOYSA-N
XLogP2.77
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenol
CID 136872164
2-[3-[3,5-bis[3,5-bis([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]-5-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine
CID 23391283
4-methoxy-2-([1,3]thiazolo[5,4-b]pyridin-2-yl)aniline
CID 113305036
5-nitro-2-([1,3]thiazolo[5,4-b]pyridin-2-yl)aniline
CID 65335840
[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-2-pyridinyl]methanamine
CID 114324844
2-(1,2,3,4-tetrahydroquinolin-5-yl)-[1,3]thiazolo[5,4-b]pyridine
CID 65335790
4-chloro-2-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenol;4-chloro-2-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenol;4-chloro-2-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenol;2-([1,3]oxazolo[4,5-b]pyridin-2-yl)-4-(trifluoromethyl)phenol;2-([1,3]oxazolo[5,4-b]pyridin-2-yl)-4-(trifluoromethyl)phenol;2-([1,3]oxazolo[4,5-c]pyridin-2-yl)-4-(trifluoromethyl)phenol;2-([1,3]thiazolo[5,4-b]pyridin-2-yl)-4-(trifluoromethyl)phenol
CID 160621191
3-(1,3-benzothiazol-2-yl)-4-hydroxybenzoic acid
CID 141481149
thieno[2,3-b]pyridin-2-ol
CID 89200152
trimethyl([1,3]thiazolo[5,4-b]pyridin-2-yl)stannane
CID 143914856
2-(1-methylimidazo[4,5-b]pyridin-2-yl)benzene-1,4-diol
CID 136756257
5-methyl-4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1H-pyrazol-3-amine
CID 66768027

Frequently Asked Questions

What is the IUPAC name of 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol?
The IUPAC name of 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol (CID 136927565) is 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol.
What is the SMILES notation for 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol?
The canonical SMILES for 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol is Oc1ccc(O)c(-c2nc3cccnc3s2)c1.
What is the InChIKey of 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol?
The InChIKey is RFTDCTGTJAWGEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O2S/c15-7-3-4-10(16)8(6-7)11-14-9-2-1-5-13-12(9)17-11/h1-6,15-16H.
What are the key properties of 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol?
2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol has a molecular weight of 244.28 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,3]thiazolo[5,4-b]pyridin-2-yl)benzene-1,4-diol is sourced from PubChem (CID 136927565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).