5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine

C7H4BrFN2S — CID 146287291

IUPAC5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCc1nc2nc(Br)c(F)cc2s1
InChIInChI=1S/C7H4BrFN2S/c1-3-10-7-5(12-3)2-4(9)6(8)11-7/h2H,1H3
InChIKeyOYYBMNRHPSVIDU-UHFFFAOYSA-N
MW247.09 g/mol
LogP2.90
Rot. Bonds

About 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine

5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 146287291) has the molecular formula C7H4BrFN2S and a molecular weight of 247.09 g/mol. Its IUPAC name is 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine
PubChem CID146287291
Molecular FormulaC7H4BrFN2S
Molecular Weight247.09 g/mol
Exact Mass245.93
IUPAC Name5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCc1nc2nc(Br)c(F)cc2s1
InChIInChI=1S/C7H4BrFN2S/c1-3-10-7-5(12-3)2-4(9)6(8)11-7/h2H,1H3
InChIKeyOYYBMNRHPSVIDU-UHFFFAOYSA-N
XLogP2.90
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.09
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-Bromo-2-chloro-[1,3]thiazolo[4,5-b]pyridine
CID 58470319
Thiazolo[4,5-b]pyridine,6-bromo-5-methyl-2-phenyl-
CID 44427393
[1,3]Thiazolo[4,5-b]pyridine-2,5-diamine
CID 2337481
6-Bromo-5-[2-(3,5-difluorophenyl)ethyl]-2-methyl-[1,3]thiazolo[4,5-b]pyridine
CID 135372260
6-Fluoro-2,5-dimethyl-[1,3]thiazolo[4,5-b]pyridine
CID 146284815
6-Fluoro-2-methylthiazolo[4,5-b]pyridine
CID 146284917
6-Fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine-5-carbonitrile
CID 146284933
6-Fluoro-2-methyl-5-vinyl-thiazolo[4,5-b]pyridine
CID 156379391
6-Fluoro-5-isocyano-2-methyl-[1,3]thiazolo[4,5-b]pyridine
CID 156678055
6-bromo-2-(7-fluoro-2H-azepin-4-yl)-[1,3]thiazolo[4,5-b]pyridine
CID 167073551
6-Bromo-2-(2,5-dimethylpyrrol-1-yl)-5-fluoro-[1,3]thiazolo[4,5-b]pyridine
CID 171486879
5-Fluoro-[1,3]thiazolo[4,5-b]pyridine
CID 171486916

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine (CID 146287291) is 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine is Cc1nc2nc(Br)c(F)cc2s1.
What is the InChIKey of 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is OYYBMNRHPSVIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrFN2S/c1-3-10-7-5(12-3)2-4(9)6(8)11-7/h2H,1H3.
What are the key properties of 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 247.09 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-fluoro-2-methyl-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 146287291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).