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N-(4-{[2,4,5-Trihydroxy-6-(hydroxymethyl)oxan-3-yl]sulfamoyl}phenyl)acetamide

HCID 229252
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Basic information

CAS
4181-03-7
Standard SMILES
CC(=O)Nc1ccc(S(=O)(=O)NC2C(O)OC(CO)C(O)C2O)cc1
InChIKey
ZPBQWDUYRAETEB-UHFFFAOYSA-N
Molecular formula
C14H20N2O8S
Average molar mass
376.38 g/mol
Monoisotopic mass
376.09403677

Names & identifiers

Preferred name
N-(4-{[2,4,5-Trihydroxy-6-(hydroxymethyl)oxan-3-yl]sulfamoyl}phenyl)acetamide
IUPAC
N-[4-[[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]sulfamoyl]phenyl]acetamide

Names & synonyms

NSC22697DTXSID701034065NSC-22697N-(4-{[2,4,5-Trihydroxy-6-(hydroxymethyl)oxan-3-yl]sulfamoyl}phenyl)acetamide4181-03-7

Database identifiers

CAS
4181-03-7
PubChem CID
229252
DTXSID
DTXSID701034065

Properties

Computed structural properties

XLogP
-2.1
Topological polar surface area
174 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
9
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
558

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