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Acetazolamide EP Impurity E

CAT: 1596-AR-A01202-06Size: 250 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-A01202-06Size:250 Units
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CAS Number
827026-60-8
Synonyms
5-acetamido-1,3,4-thiadiazole-2-sulfonic acid;2- (Acetylamino) -5-sulfo-1,3,4-thiadiazole; Acetazolamide EP Impurity E
Molecular Formula
C4H5N3O4S2
Molecular Weight
223.23
API Name
Acetazolamide

Chemical Information

5-Acetamido-1,3,4-thiadiazole-2-sulfonic acid
CAS Number827026-60-8
PubChem CID56924023
IUPAC Name5-acetamido-1,3,4-thiadiazole-2-sulfonic acid
Molecular FormulaC4H5N3O4S2
Molecular Weight223.2
XLogP-0.1
Topological Polar Surface Area146
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity297
SMILES
CC(=O)NC1=NN=C(S1)S(=O)(=O)O
InChI
InChI=1S/C4H5N3O4S2/c1-2(8)5-3-6-7-4(12-3)13(9,10)11/h1H3,(H,5,6,8)(H,9,10,11)
InChIKey
YLYWNBBQDHCLJL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Acetamido-1,3,4-thiadiazole-2-sulfonic acid
CAS: 827026-60-8
CID: 56924023
Formula: C4H5N3O4S2
MW: 223.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight223.2
XLogP3-0.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass222.97214800
Monoisotopic Mass222.97214800
Topological Polar Surface Area146 Ų
Heavy Atom Count13
Formal Charge0
Complexity297
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes