6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one

C6H3ClN2OS — CID 2747576

IUPAC6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one
SMILESO=c1[nH]c2cc(Cl)cnc2s1
InChIInChI=1S/C6H3ClN2OS/c7-3-1-4-5(8-2-3)11-6(10)9-4/h1-2H,(H,9,10)
InChIKeyHFLUEPQJJWCETM-UHFFFAOYSA-N
MW186.62 g/mol
LogP1.64
Rot. Bonds

About 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one

6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one (PubChem CID 2747576) has the molecular formula C6H3ClN2OS and a molecular weight of 186.62 g/mol. Its IUPAC name is 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one.

Molecular Properties

Compound Name6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one
PubChem CID2747576
Molecular FormulaC6H3ClN2OS
Molecular Weight186.62 g/mol
Exact Mass185.97
IUPAC Name6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one
SMILESO=c1[nH]c2cc(Cl)cnc2s1
InChIInChI=1S/C6H3ClN2OS/c7-3-1-4-5(8-2-3)11-6(10)9-4/h1-2H,(H,9,10)
InChIKeyHFLUEPQJJWCETM-UHFFFAOYSA-N
XLogP1.64
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.62
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-Chloro-(1,3)thiazolo(4,5-c)pyridine-2-thiol
CID 58579707
Thiazolo[5,4-b]pyridin-2(1H)-one
CID 13323937
1,2-Dihydrothiazolo[5,4-b]pyridine
CID 17769189
6-Fluorothiazolo[5,4-b]pyridin-2(1H)-one
CID 68816242
5-Chloro-2-(trifluoromethylthio)pyridine-3-amine
CID 75530013
6-Chloro-1-carboxymethyl-2-oxo-1,2-dihydrothiazolo[5,4-b]pyridine
CID 11010206
7-Chlorothiazolo[4,5-C]pyridine-2-thiol
CID 11849875
6-Chloro-1-methoxycarbonylmethyl-2-oxo-1,2-dihydrothiazolo[5,4-b]pyridine
CID 14098030
6-Chloro-2-oxo-1-[(4-methyl-1-piperazinyl)carbonylmethyl]-1,2-dihydrothiazolo[5,4-b]pyridine
CID 14423122
6-Chloro-2-oxo-1-[(4-acetonyl-1-piperazinyl)carbonylmethyl]-1,2-dihydrothiazolo[5,4-b]pyridine
CID 14423125
5-Chlorothiazolo[5,4-b]pyridin-2(1H)-one
CID 14423128
6-Chloro-2-oxo-1-[(1-piperazinyl)carbonylmethyl]-1,2-dihydrothiazolo[5,4-b]pyridine
CID 19837972

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one?
The IUPAC name of 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one (CID 2747576) is 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one.
What is the SMILES notation for 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one?
The canonical SMILES for 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one is O=c1[nH]c2cc(Cl)cnc2s1.
What is the InChIKey of 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one?
The InChIKey is HFLUEPQJJWCETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClN2OS/c7-3-1-4-5(8-2-3)11-6(10)9-4/h1-2H,(H,9,10).
What are the key properties of 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one?
6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one has a molecular weight of 186.62 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1H-[1,3]thiazolo[5,4-b]pyridin-2-one is sourced from PubChem (CID 2747576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).