1-(2,1,3-Benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylic acid

Base Information

• Chemical Name: 1-(2,1,3-Benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylic acid
• CAS No.: 329271-68-3
• Molecular Formula: C11H11N3O4S2
• Molecular Weight: 313.4
• ChEMBL ID: CHEMBL1868177
• Mol file: 329271-68-3.mol

Synonyms:1-(2,1,3-benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylic acid;329271-68-3;1-(Benzo[1,2,5]thiadiazole-4-sulfonyl)-pyrrolidine-2-carboxylic acid;1-(2,1,3-benzothiadiazole-4-sulfonyl)pyrrolidine-2-carboxylic acid;ChemDiv1_000197;Cambridge id 5705693;Oprea1_334922;Oprea1_669161;MLS000703318;CHEMBL1868177;HMS587I21;HMS2645K22;CCG-15136;MFCD00658796;AKOS000265147;AKOS002217603;AKOS016042213;AKOS016307500;LS-02330;SMR000273782;EU-0033562;1-(2,1,3-benzothiadiazol-4-ylsulfonyl)proline;SR-01000390033;SR-01000390033-1;Z56853717

Chemical Property of 1-(2,1,3-Benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylic acid

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 313.01909819
• Heavy Atom Count: 20
• Complexity: 492

Purity/Quality:

98%min ^*data from raw suppliers

1-(Benzo[1,2,5]thiadiazole-4-sulfonyl)-pyrrolidine-2-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

Useful:

• Canonical SMILES: C1CC(N(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)O

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