7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonic acid amide

Base Information

• Chemical Name: 7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonic acid amide
• CAS No.: 105951-32-4
• Molecular Formula: C7H7NO3S3
• ChEMBL ID: CHEMBL120418
• DSSTox Substance ID: DTXSID40872102
• Nikkaji Number: J1.552.668H
• Pharos Ligand ID: 2APA28TUFKLL
• Mol file: 105951-32-4.mol

Synonyms:CHEMBL120418;105951-32-4;SCHEMBL10512559;DTXSID40872102;BDBM50024220;7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonamide;7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonic acid amide

Chemical Property of 7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonic acid amide

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 248.95880661
• Heavy Atom Count: 14
• Complexity: 348

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CSC2=C(C1=O)SC(=C2)S(=O)(=O)N