2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride

C6H4Cl2N2S — CID 57482765

IUPAC2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride
SMILESCl.Clc1nc2ncccc2s1
InChIInChI=1S/C6H3ClN2S.ClH/c7-6-9-5-4(10-6)2-1-3-8-5;/h1-3H;1H
InChIKeyXKXJVWHKMUYXGT-UHFFFAOYSA-N
MW207.09 g/mol
LogP2.77
Rot. Bonds

About 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride

2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride (PubChem CID 57482765) has the molecular formula C6H4Cl2N2S and a molecular weight of 207.09 g/mol. Its IUPAC name is 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride.

Molecular Properties

Compound Name2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride
PubChem CID57482765
Molecular FormulaC6H4Cl2N2S
Molecular Weight207.09 g/mol
Exact Mass205.95
IUPAC Name2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride
SMILESCl.Clc1nc2ncccc2s1
InChIInChI=1S/C6H3ClN2S.ClH/c7-6-9-5-4(10-6)2-1-3-8-5;/h1-3H;1H
InChIKeyXKXJVWHKMUYXGT-UHFFFAOYSA-N
XLogP2.77
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.09
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride?
The IUPAC name of 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride (CID 57482765) is 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride.
What is the SMILES notation for 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride?
The canonical SMILES for 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride is Cl.Clc1nc2ncccc2s1.
What is the InChIKey of 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride?
The InChIKey is XKXJVWHKMUYXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClN2S.ClH/c7-6-9-5-4(10-6)2-1-3-8-5;/h1-3H;1H.
What are the key properties of 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride?
2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride has a molecular weight of 207.09 g/mol, XLogP of 2.77, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride is sourced from PubChem (CID 57482765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).