N-(2-cyanoethyl)-N-(4-methoxyphenyl)-2,1,3-benzothiadiazole-4-sulfonamide

Base Information

• Chemical Name: N-(2-cyanoethyl)-N-(4-methoxyphenyl)-2,1,3-benzothiadiazole-4-sulfonamide
• CAS No.: 5175-50-8
• Molecular Formula: C16H14N4O3S2
• Molecular Weight: 374.4374
• DSSTox Substance ID: DTXSID60365405
• Wikidata: Q82150049
• ChEMBL ID: CHEMBL1368436
• Mol file: 5175-50-8.mol

Synonyms:N-(2-cyanoethyl)-N-(4-methoxyphenyl)-2,1,3-benzothiadiazole-4-sulfonamide;313241-72-4;5175-50-8;MLS000391977;Cambridge id 5175508;Oprea1_143844;Oprea1_341352;CHEMBL1368436;DTXSID60365405;HMS1672G01;HMS2574L23;STK832609;AKOS000539023;N-(2-cyanoethyl)-N-(4-methoxyphenyl)benzo[c][1,2,5]thiadiazole-4-sulfonamide;SMR000102497;EU-0033617;AB00074911-01;SR-01000390907;SR-01000390907-1;F0347-0752;N~4~-(2-cyanoethyl)-N~4~-(4-methoxyphenyl)-2,1,3-benzothiadiazole-4-sulfonamide

Chemical Property of N-(2-cyanoethyl)-N-(4-methoxyphenyl)-2,1,3-benzothiadiazole-4-sulfonamide

Chemical Property:

• Vapor Pressure: 1.62E-14mmHg at 25°C
• Boiling Point: 603.5°Cat760mmHg
• Flash Point: 318.8°C
• Density: 1.453g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 374.05073267
• Heavy Atom Count: 25
• Complexity: 592

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)N(CCC#N)S(=O)(=O)C2=CC=CC3=NSN=C32