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1778151-23-7 | 4-hydroxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzene-1-sulfonamide
CAS No: 1778151-23-7 Catalog No: AG01BA80 MDL No:MFCD27797660
Product Description
Catalog Number:
AG01BA80
Chemical Name:
4-hydroxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzene-1-sulfonamide
CAS Number:
1778151-23-7
Molecular Formula:
C9H9N3O3S2
Molecular Weight:
271.3161
MDL Number:
MFCD27797660
IUPAC Name:
4-hydroxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzenesulfonamide
InChI:
InChI=1S/C9H9N3O3S2/c1-6-10-9(16-11-6)12-17(14,15)8-4-2-7(13)3-5-8/h2-5,13H,1H3,(H,10,11,12)
InChI Key:
LEHSELWVPQSQAP-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)S(=O)(=O)Nc1snc(n1)C
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.009g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
271.309g/mol
Monoisotopic Mass:
271.009g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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