SULFISOMIDINE

Base Information

• Chemical Name: SULFISOMIDINE
• CAS No.: 515-64-0
• Molecular Formula: C12H14 N4 O2 S
• Molecular Weight: 278.335
• Hs Code.: 2935009090
• European Community (EC) Number: 208-204-3
• UNII: W03L3ODK6E
• DSSTox Substance ID: DTXSID1046390
• Nikkaji Number: J4.404K
• Wikipedia: Sulfisomidine
• Wikidata: Q6577315
• NCI Thesaurus Code: C152463
• Metabolomics Workbench ID: 54500
• ChEMBL ID: CHEMBL485696
• Mol file: 515-64-0.mol

Synonyms:Sulfanilamide,N1-(2,6-dimethyl-4-pyrimidinyl)- (8CI); 2,4-Dimethyl-6-sulfanilamidopyrimidine;2,6-Dimethyl-4-sulfanilamidopyrimidine; 4-Sulfanilamido-2,6-dimethylpyrimidine;4-[[(2,6-Dimethylpyrimidin-4-yl)amino]sulfonyl]aniline;6-(4-Aminobenzenesulfonamido)-2,4-dimethylpyrimidine;6-(Sulfanilamido)-2,4-dimethyl-1,3-diazine; 6-(p-Aminobenzenesulfonamido)-2,4-dimethylpyrimidine;6-(p-Aminophenylsulfonamido)-2,4-dimethylpyrimidine;6-Sulfanilamido-2,4-dimethylpyrimidine;6-[(p-Aminobenzenesulfonyl)amino]-2,4-dimethylpyrimidine; Aristamid; Aristogyn;Domain; Domian; Elcosin; Elcosine; Elkosil; Elkosin; Elkosine; Elkozin; Erycon;Mefenal; N1-(2,6-Dimethyl-4-pyrimidinyl)sulfanilamide; Sulfadimetine;Sulfaisodimerazine; Sulfamethine; Sulfasomidin; Sulfasomidine; Sulfisomidin;Sulfisomidine; Sulphasomidine; Sulphisomidine

Chemical Property of SULFISOMIDINE

Chemical Property:

• Vapor Pressure: 2.12E-09mmHg at 25°C
• Melting Point: 245°C
• Refractive Index: 1.6440 (estimate)
• Boiling Point: 480.7°C at 760 mmHg
• PKA: pKa 7.25 (Uncertain)
• Flash Point: 244.5°C
• PSA: 106.35000
• Density: 1.392g/cm³
• LogP: 3.21140
• Storage Temp.: 0-6°C
• Solubility.: Acetonitrile (Slightly), DMSO (Slightly)
• Water Solubility.: 1.382g/L(25 oC)
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 278.08374688
• Heavy Atom Count: 19
• Complexity: 387

Purity/Quality:

99% ^*data from raw suppliers

Sulfisomidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 22-24/25-36-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)N
• Uses: Sulfisomidine is a sulfanilamide antibacterial agent.
• Therapeutic Function: Antibacterial

Technology Process of SULFISOMIDINE

There total 13 articles about SULFISOMIDINE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

4-amino-2,6-dimethylpyrimidine (461-98-3) → Sulfasomidin (515-64-0)

Guidance literature:

Multi-step reaction with 2 steps

2: nickel; aqueous ethanol / Hydrogenation

With ethanol; nickel;

Reference yield:

4-amino-2,6-dimethylpyrimidine (461-98-3) + p-acetylaminobenzenesulfonyl chloride (121-60-8) → Sulfasomidin (515-64-0)

Guidance literature:

With pyridine; dichloromethane; anschliessendes Hydrolysieren;

Reference yield:

4-nitro-benzenesulfonic acid-(2,6-dimethyl-pyrimidin-4-ylamide) (847700-01-0) → Sulfasomidin (515-64-0)

Guidance literature:

With ethanol; nickel; Hydrogenation;

upstream raw materials:

4-chloro-2,6-dimethylpyrimidine

sulfanilamide

4-amino-2,6-dimethylpyrimidine

p-acetylaminobenzenesulfonyl chloride

Downstream raw materials:

N-(2,6-Dimethyl-pyrimidin-4-yl)-4-{4-[1-(4-hydroxy-3-methoxy-phenyl)-meth-(Z)-ylidene]-5-oxo-2-phenyl-4,5-dihydro-imidazol-1-yl}-benzenesulfonamide

N-(2,6-Dimethyl-pyrimidin-4-yl)-4-[6-hydroxy-2-oxo-7-undecyl-2,3-dihydro-benzoimidazol-(5E)-ylideneamino]-benzenesulfonamide

Refernces