4-quinolin-3-ylbenzenesulfonamide

C15H12N2O2S — CID 122707123

IUPAC4-quinolin-3-ylbenzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2cnc3ccccc3c2)cc1
InChIInChI=1S/C15H12N2O2S/c16-20(18,19)14-7-5-11(6-8-14)13-9-12-3-1-2-4-15(12)17-10-13/h1-10H,(H2,16,18,19)
InChIKeyHGZKFXIUXSUJHM-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.55
Rot. Bonds2

About 4-quinolin-3-ylbenzenesulfonamide

4-quinolin-3-ylbenzenesulfonamide (PubChem CID 122707123) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 4-quinolin-3-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-quinolin-3-ylbenzenesulfonamide
PubChem CID122707123
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name4-quinolin-3-ylbenzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2cnc3ccccc3c2)cc1
InChIInChI=1S/C15H12N2O2S/c16-20(18,19)14-7-5-11(6-8-14)13-9-12-3-1-2-4-15(12)17-10-13/h1-10H,(H2,16,18,19)
InChIKeyHGZKFXIUXSUJHM-UHFFFAOYSA-N
XLogP2.55
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-quinolin-3-ylbenzenesulfonamide?
The IUPAC name of 4-quinolin-3-ylbenzenesulfonamide (CID 122707123) is 4-quinolin-3-ylbenzenesulfonamide.
What is the SMILES notation for 4-quinolin-3-ylbenzenesulfonamide?
The canonical SMILES for 4-quinolin-3-ylbenzenesulfonamide is NS(=O)(=O)c1ccc(-c2cnc3ccccc3c2)cc1.
What is the InChIKey of 4-quinolin-3-ylbenzenesulfonamide?
The InChIKey is HGZKFXIUXSUJHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c16-20(18,19)14-7-5-11(6-8-14)13-9-12-3-1-2-4-15(12)17-10-13/h1-10H,(H2,16,18,19).
What are the key properties of 4-quinolin-3-ylbenzenesulfonamide?
4-quinolin-3-ylbenzenesulfonamide has a molecular weight of 284.34 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-quinolin-3-ylbenzenesulfonamide is sourced from PubChem (CID 122707123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).