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Sulfalex

C11H12N4O3S — CID 5330

💊View drug profile → sulfamethoxypyridazine

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1
InChIInChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)
InChIKeyVLYWMPOKSSWJAL-UHFFFAOYSA-N
MW280.31 g/mol
LogP0.87
Rot. Bonds4

About Sulfalex

Sulfalex (PubChem CID 5330) has the molecular formula C11H12N4O3S and a molecular weight of 280.31 g/mol. Its IUPAC name is 4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide.

Molecular Properties

Compound NameSulfalex
PubChem CID5330
Molecular FormulaC11H12N4O3S
Molecular Weight280.31 g/mol
Exact Mass280.06
IUPAC Name4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1
InChIInChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)
InChIKeyVLYWMPOKSSWJAL-UHFFFAOYSA-N
XLogP0.87
TPSA107.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

Sulfaethoxypyridazine
CID 13755
N-((4-Aminophenyl)sulfonyl)-N-(6-methoxy-3-pyridazinyl)acetamide
CID 19122
4-[(6-Methoxypyridazin-3-yl)amino]benzenesulfonamide
CID 57011620
sulfamethoxypyridazine sodium salt
CID 12790147
3,3,3-trifluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-2-methyl-2-(trifluoromethyl)propanamide
CID 6400925
N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-4-methylbenzenesulfonamide
CID 2834195
4-{[(E)-(4-methoxyphenyl)methylidene]amino}-N-(6-methoxypyridazin-3-yl)benzenesulfonamide
CID 6406956
4-Amino-N-(6-(trideuteriomethoxy)pyridazin-3-yl)benzenesulfonamide
CID 71312424

Frequently Asked Questions

What is the IUPAC name of Sulfalex?
The IUPAC name of Sulfalex (CID 5330) is 4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide.
What is the SMILES notation for Sulfalex?
The canonical SMILES for Sulfalex is COc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1.
What is the InChIKey of Sulfalex?
The InChIKey is VLYWMPOKSSWJAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15).
What are the key properties of Sulfalex?
Sulfalex has a molecular weight of 280.31 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for Sulfalex is sourced from PubChem (CID 5330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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