[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride

C6H4ClN3O2S — CID 83821830

IUPAC[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc2ncnn2c1
InChIInChI=1S/C6H4ClN3O2S/c7-13(11,12)5-1-2-6-8-4-9-10(6)3-5/h1-4H
InChIKeyJJDGPAIQSHBVFC-UHFFFAOYSA-N
MW217.64 g/mol
LogP0.66
Rot. Bonds1

About [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride

[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride (PubChem CID 83821830) has the molecular formula C6H4ClN3O2S and a molecular weight of 217.64 g/mol. Its IUPAC name is [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride.

Molecular Properties

Compound Name[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride
PubChem CID83821830
Molecular FormulaC6H4ClN3O2S
Molecular Weight217.64 g/mol
Exact Mass216.97
IUPAC Name[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc2ncnn2c1
InChIInChI=1S/C6H4ClN3O2S/c7-13(11,12)5-1-2-6-8-4-9-10(6)3-5/h1-4H
InChIKeyJJDGPAIQSHBVFC-UHFFFAOYSA-N
XLogP0.66
TPSA64.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.64
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride?
The IUPAC name of [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride (CID 83821830) is [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride.
What is the SMILES notation for [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride?
The canonical SMILES for [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride is O=S(=O)(Cl)c1ccc2ncnn2c1.
What is the InChIKey of [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride?
The InChIKey is JJDGPAIQSHBVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClN3O2S/c7-13(11,12)5-1-2-6-8-4-9-10(6)3-5/h1-4H.
What are the key properties of [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride?
[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride has a molecular weight of 217.64 g/mol, XLogP of 0.66, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride is sourced from PubChem (CID 83821830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).