2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride

C11H7Cl2NO3S — CID 117167869

IUPAC2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccnc(Oc2ccccc2Cl)c1
InChIInChI=1S/C11H7Cl2NO3S/c12-9-3-1-2-4-10(9)17-11-7-8(5-6-14-11)18(13,15)16/h1-7H
InChIKeyOPPNEUVMUMLTOT-UHFFFAOYSA-N
MW304.15 g/mol
LogP3.45
Rot. Bonds3

About 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride

2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride (PubChem CID 117167869) has the molecular formula C11H7Cl2NO3S and a molecular weight of 304.15 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride.

Molecular Properties

Compound Name2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride
PubChem CID117167869
Molecular FormulaC11H7Cl2NO3S
Molecular Weight304.15 g/mol
Exact Mass302.95
IUPAC Name2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccnc(Oc2ccccc2Cl)c1
InChIInChI=1S/C11H7Cl2NO3S/c12-9-3-1-2-4-10(9)17-11-7-8(5-6-14-11)18(13,15)16/h1-7H
InChIKeyOPPNEUVMUMLTOT-UHFFFAOYSA-N
XLogP3.45
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.15
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride?
The IUPAC name of 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride (CID 117167869) is 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride.
What is the SMILES notation for 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride?
The canonical SMILES for 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride is O=S(=O)(Cl)c1ccnc(Oc2ccccc2Cl)c1.
What is the InChIKey of 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride?
The InChIKey is OPPNEUVMUMLTOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2NO3S/c12-9-3-1-2-4-10(9)17-11-7-8(5-6-14-11)18(13,15)16/h1-7H.
What are the key properties of 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride?
2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride has a molecular weight of 304.15 g/mol, XLogP of 3.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)pyridine-4-sulfonyl chloride is sourced from PubChem (CID 117167869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).