N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide

C22H19N3O2S — CID 71295981

IUPACN-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C22H19N3O2S/c1-2-28(26,27)25-18-13-14-19-20(15-18)24-22(17-11-7-4-8-12-17)21(23-19)16-9-5-3-6-10-16/h3-15,25H,2H2,1H3
InChIKeyJYGYZEUHAWKTMP-UHFFFAOYSA-N
MW389.48 g/mol
LogP4.73
Rot. Bonds5

About N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide

N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide (PubChem CID 71295981) has the molecular formula C22H19N3O2S and a molecular weight of 389.48 g/mol. Its IUPAC name is N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide
PubChem CID71295981
Molecular FormulaC22H19N3O2S
Molecular Weight389.48 g/mol
Exact Mass389.12
IUPAC NameN-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C22H19N3O2S/c1-2-28(26,27)25-18-13-14-19-20(15-18)24-22(17-11-7-4-8-12-17)21(23-19)16-9-5-3-6-10-16/h3-15,25H,2H2,1H3
InChIKeyJYGYZEUHAWKTMP-UHFFFAOYSA-N
XLogP4.73
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide?
The IUPAC name of N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide (CID 71295981) is N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide.
What is the SMILES notation for N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide?
The canonical SMILES for N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide is CCS(=O)(=O)Nc1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1.
What is the InChIKey of N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide?
The InChIKey is JYGYZEUHAWKTMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2S/c1-2-28(26,27)25-18-13-14-19-20(15-18)24-22(17-11-7-4-8-12-17)21(23-19)16-9-5-3-6-10-16/h3-15,25H,2H2,1H3.
What are the key properties of N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide?
N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide has a molecular weight of 389.48 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-diphenylquinoxalin-6-yl)ethanesulfonamide is sourced from PubChem (CID 71295981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).