4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide

C16H15N3O3S — CID 110723752

IUPAC4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc3nccnc3c2)c(C)c1
InChIInChI=1S/C16H15N3O3S/c1-11-9-13(22-2)4-6-16(11)23(20,21)19-12-3-5-14-15(10-12)18-8-7-17-14/h3-10,19H,1-2H3
InChIKeyLYVAPBQSZYCZTI-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.75
Rot. Bonds4

About 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide

4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide (PubChem CID 110723752) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
PubChem CID110723752
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC Name4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc3nccnc3c2)c(C)c1
InChIInChI=1S/C16H15N3O3S/c1-11-9-13(22-2)4-6-16(11)23(20,21)19-12-3-5-14-15(10-12)18-8-7-17-14/h3-10,19H,1-2H3
InChIKeyLYVAPBQSZYCZTI-UHFFFAOYSA-N
XLogP2.75
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

4-methoxy-2-methyl-N-(1-methylbenzimidazol-5-yl)benzenesulfonamide
CID 110728593
4-fluoro-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
CID 110723750
4-methoxy-N-(4-methoxy-3-methylphenyl)-2-methylbenzenesulfonamide
CID 110776438
N-(3-amino-4-methylphenyl)-4-methoxy-2-methylbenzenesulfonamide
CID 39439925
[4-[(4-methoxy-2-methylphenyl)sulfonylamino]phenyl]urea
CID 47062796
N-(3,4-dimethylphenyl)-2,4-dimethoxybenzenesulfonamide
CID 19683549
3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide
CID 87026601
N-[4-(butylamino)phenyl]-4-methoxy-2-methylbenzenesulfonamide
CID 112980291
4-methoxy-N-[6-(2-methoxyethylamino)-3-pyridinyl]-2-methylbenzenesulfonamide
CID 113010409
4-methoxy-2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
CID 47062849
4-methoxy-2-methyl-N-[4-(pyridin-3-ylmethylamino)phenyl]benzenesulfonamide
CID 112983082
4-methoxy-2-methyl-N-[4-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide
CID 51121436

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide?
The IUPAC name of 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide (CID 110723752) is 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccc3nccnc3c2)c(C)c1.
What is the InChIKey of 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide?
The InChIKey is LYVAPBQSZYCZTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-11-9-13(22-2)4-6-16(11)23(20,21)19-12-3-5-14-15(10-12)18-8-7-17-14/h3-10,19H,1-2H3.
What are the key properties of 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide?
4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide has a molecular weight of 329.38 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide is sourced from PubChem (CID 110723752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).