4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide

C10H9ClN4O2S — CID 6634

💊View drug profile → sulfachlorpyridazine
IUPAC4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide
SMILESNc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1
InChIInChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)
InChIKeyXOXHILFPRYWFOD-UHFFFAOYSA-N
MW284.73 g/mol
LogP1.51
Rot. Bonds3

About 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide

4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide (PubChem CID 6634) has the molecular formula C10H9ClN4O2S and a molecular weight of 284.73 g/mol. Its IUPAC name is 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide
PubChem CID6634
Molecular FormulaC10H9ClN4O2S
Molecular Weight284.73 g/mol
Exact Mass284.01
IUPAC Name4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide
SMILESNc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1
InChIInChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)
InChIKeyXOXHILFPRYWFOD-UHFFFAOYSA-N
XLogP1.51
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.73
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(6-chloropyridazin-3-yl)benzenesulfonamide
CID 6407597
Sulfachlorpyridazine Sodium
CID 15622288
N'-(6-chloro-3-pyridazinyl)-4-fluorobenzenesulfonohydrazide
CID 6401640
N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}acetamide
CID 6401119
N-[4-(6-Chloro-pyridazin-3-ylsulfamoyl)-phenyl]-propionamide
CID 15944699
Pyridazine, 3-sulphanilamido-
CID 6403208
N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}propanamide
CID 6401226
N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}hexanamide
CID 6405325
N-(6-chloropyridazin-3-yl)-4-methylbenzenesulfonamide
CID 3153536
N'-(6-chloropyridazin-3-yl)-4-methylbenzenesulfonohydrazide
CID 25761647
(4-(6-Chloro-pyridazin-3-ylsulfamoyl)-phenyl)-carbamic acid ethyl ester
CID 129689615
4-chloro-N-(6-cyclopropylpyridazin-3-yl)benzenesulfonamide
CID 122151064

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide?
The IUPAC name of 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide (CID 6634) is 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide?
The canonical SMILES for 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide is Nc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1.
What is the InChIKey of 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide?
The InChIKey is XOXHILFPRYWFOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15).
What are the key properties of 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide?
4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide has a molecular weight of 284.73 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonamide is sourced from PubChem (CID 6634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).