6-Nitro-2-benzothiazolesulfonamide

Base Information

• Chemical Name: 6-Nitro-2-benzothiazolesulfonamide
• CAS No.: 94641-10-8
• Molecular Formula: C₇H₅N₃O₄S₂
• Molecular Weight: 259.266
• ChEMBL ID: CHEMBL186335
• DSSTox Substance ID: DTXSID90879045
• Nikkaji Number: J1.541.697A
• Pharos Ligand ID: S8DJV8VNBWZF
• Wikidata: Q82861081

Synonyms:CHEMBL186335;6-nitro-2-benzothiazolesulfonamide;6-Nitro-benzothiazole-2-sulfonic acid amide;94641-10-8;SCHEMBL10347981;DTXSID90879045;VDPWQQORTOWPSP-UHFFFAOYSA-N;6-nitrobenzothiazole-2-sulfonamide;BDBM50155503;2-Benzothiazolesulfonamide, 6-nitro-;PD182989

Chemical Property of 6-Nitro-2-benzothiazolesulfonamide

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 258.97214800
• Heavy Atom Count: 16
• Complexity: 387

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)S(=O)(=O)N

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