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

C7H4BrClN2S — CID 89438722

IUPAC2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine
SMILESCc1nc2sc(Br)nc2cc1Cl
InChIInChI=1S/C7H4BrClN2S/c1-3-4(9)2-5-6(10-3)12-7(8)11-5/h2H,1H3
InChIKeyQZGQIXSEWBNJGS-UHFFFAOYSA-N
MW263.55 g/mol
LogP3.42
Rot. Bonds

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

2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 89438722) has the molecular formula C7H4BrClN2S and a molecular weight of 263.55 g/mol. Its IUPAC name is 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine
PubChem CID89438722
Molecular FormulaC7H4BrClN2S
Molecular Weight263.55 g/mol
Exact Mass261.90
IUPAC Name2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine
SMILESCc1nc2sc(Br)nc2cc1Cl
InChIInChI=1S/C7H4BrClN2S/c1-3-4(9)2-5-6(10-3)12-7(8)11-5/h2H,1H3
InChIKeyQZGQIXSEWBNJGS-UHFFFAOYSA-N
XLogP3.42
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.55
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine (CID 89438722) is 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine is Cc1nc2sc(Br)nc2cc1Cl.
What is the InChIKey of 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is QZGQIXSEWBNJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrClN2S/c1-3-4(9)2-5-6(10-3)12-7(8)11-5/h2H,1H3.
What are the key properties of 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine?
2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 263.55 g/mol, XLogP of 3.42, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-chloro-5-methyl-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 89438722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).