2-(4-chlorophenyl)sulfonylquinoline

C15H10ClNO2S — CID 122229120

IUPAC2-(4-chlorophenyl)sulfonylquinoline
SMILESO=S(=O)(c1ccc(Cl)cc1)c1ccc2ccccc2n1
InChIInChI=1S/C15H10ClNO2S/c16-12-6-8-13(9-7-12)20(18,19)15-10-5-11-3-1-2-4-14(11)17-15/h1-10H
InChIKeyIMGNDUFVTNYWTP-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.72
Rot. Bonds2

About 2-(4-chlorophenyl)sulfonylquinoline

2-(4-chlorophenyl)sulfonylquinoline (PubChem CID 122229120) has the molecular formula C15H10ClNO2S and a molecular weight of 303.77 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonylquinoline.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonylquinoline
PubChem CID122229120
Molecular FormulaC15H10ClNO2S
Molecular Weight303.77 g/mol
Exact Mass303.01
IUPAC Name2-(4-chlorophenyl)sulfonylquinoline
SMILESO=S(=O)(c1ccc(Cl)cc1)c1ccc2ccccc2n1
InChIInChI=1S/C15H10ClNO2S/c16-12-6-8-13(9-7-12)20(18,19)15-10-5-11-3-1-2-4-14(11)17-15/h1-10H
InChIKeyIMGNDUFVTNYWTP-UHFFFAOYSA-N
XLogP3.72
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-chlorophenyl)sulfonylquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonylquinoline?
The IUPAC name of 2-(4-chlorophenyl)sulfonylquinoline (CID 122229120) is 2-(4-chlorophenyl)sulfonylquinoline.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonylquinoline?
The canonical SMILES for 2-(4-chlorophenyl)sulfonylquinoline is O=S(=O)(c1ccc(Cl)cc1)c1ccc2ccccc2n1.
What is the InChIKey of 2-(4-chlorophenyl)sulfonylquinoline?
The InChIKey is IMGNDUFVTNYWTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClNO2S/c16-12-6-8-13(9-7-12)20(18,19)15-10-5-11-3-1-2-4-14(11)17-15/h1-10H.
What are the key properties of 2-(4-chlorophenyl)sulfonylquinoline?
2-(4-chlorophenyl)sulfonylquinoline has a molecular weight of 303.77 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonylquinoline is sourced from PubChem (CID 122229120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).