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

C7H5BrN2S — CID 153383397

IUPAC2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine
SMILESCc1cc2sc(Br)nc2cn1
InChIInChI=1S/C7H5BrN2S/c1-4-2-6-5(3-9-4)10-7(8)11-6/h2-3H,1H3
InChIKeyGNTLQGRNKCBHOO-UHFFFAOYSA-N
MW229.10 g/mol
LogP2.76
Rot. Bonds

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

2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 153383397) has the molecular formula C7H5BrN2S and a molecular weight of 229.10 g/mol. Its IUPAC name is 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine
PubChem CID153383397
Molecular FormulaC7H5BrN2S
Molecular Weight229.10 g/mol
Exact Mass227.94
IUPAC Name2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine
SMILESCc1cc2sc(Br)nc2cn1
InChIInChI=1S/C7H5BrN2S/c1-4-2-6-5(3-9-4)10-7(8)11-6/h2-3H,1H3
InChIKeyGNTLQGRNKCBHOO-UHFFFAOYSA-N
XLogP2.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.10
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine (CID 153383397) is 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine is Cc1cc2sc(Br)nc2cn1.
What is the InChIKey of 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is GNTLQGRNKCBHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrN2S/c1-4-2-6-5(3-9-4)10-7(8)11-6/h2-3H,1H3.
What are the key properties of 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine?
2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 229.10 g/mol, XLogP of 2.76, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 153383397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).