4-phenyl-N-quinolin-8-ylbenzenesulfonamide

C21H16N2O2S — CID 3809258

IUPAC4-phenyl-N-quinolin-8-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1cccc2cccnc12)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H16N2O2S/c24-26(25,23-20-10-4-8-18-9-5-15-22-21(18)20)19-13-11-17(12-14-19)16-6-2-1-3-7-16/h1-15,23H
InChIKeyXMISBOWBHJYIPU-UHFFFAOYSA-N
MW360.44 g/mol
LogP4.70
Rot. Bonds4

About 4-phenyl-N-quinolin-8-ylbenzenesulfonamide

4-phenyl-N-quinolin-8-ylbenzenesulfonamide (PubChem CID 3809258) has the molecular formula C21H16N2O2S and a molecular weight of 360.44 g/mol. Its IUPAC name is 4-phenyl-N-quinolin-8-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-phenyl-N-quinolin-8-ylbenzenesulfonamide
PubChem CID3809258
Molecular FormulaC21H16N2O2S
Molecular Weight360.44 g/mol
Exact Mass360.09
IUPAC Name4-phenyl-N-quinolin-8-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1cccc2cccnc12)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H16N2O2S/c24-26(25,23-20-10-4-8-18-9-5-15-22-21(18)20)19-13-11-17(12-14-19)16-6-2-1-3-7-16/h1-15,23H
InChIKeyXMISBOWBHJYIPU-UHFFFAOYSA-N
XLogP4.70
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-phenyl-N-quinolin-8-ylbenzenesulfonamide 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 4-phenyl-N-quinolin-8-ylbenzenesulfonamide?
The IUPAC name of 4-phenyl-N-quinolin-8-ylbenzenesulfonamide (CID 3809258) is 4-phenyl-N-quinolin-8-ylbenzenesulfonamide.
What is the SMILES notation for 4-phenyl-N-quinolin-8-ylbenzenesulfonamide?
The canonical SMILES for 4-phenyl-N-quinolin-8-ylbenzenesulfonamide is O=S(=O)(Nc1cccc2cccnc12)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-quinolin-8-ylbenzenesulfonamide?
The InChIKey is XMISBOWBHJYIPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O2S/c24-26(25,23-20-10-4-8-18-9-5-15-22-21(18)20)19-13-11-17(12-14-19)16-6-2-1-3-7-16/h1-15,23H.
What are the key properties of 4-phenyl-N-quinolin-8-ylbenzenesulfonamide?
4-phenyl-N-quinolin-8-ylbenzenesulfonamide has a molecular weight of 360.44 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-quinolin-8-ylbenzenesulfonamide is sourced from PubChem (CID 3809258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).