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1823522-00-4 | 2-butanoyl-4-methyl-1,3-thiazole-5-sulfonamide
CAS No: 1823522-00-4 Catalog No: AG01BH78 MDL No:MFCD28139541
Product Description
Catalog Number:
AG01BH78
Chemical Name:
2-butanoyl-4-methyl-1,3-thiazole-5-sulfonamide
CAS Number:
1823522-00-4
Molecular Formula:
C8H12N2O3S2
Molecular Weight:
248.3225
MDL Number:
MFCD28139541
IUPAC Name:
2-butanoyl-4-methyl-1,3-thiazole-5-sulfonamide
InChI:
InChI=1S/C8H12N2O3S2/c1-3-4-6(11)7-10-5(2)8(14-7)15(9,12)13/h3-4H2,1-2H3,(H2,9,12,13)
InChI Key:
VHBXHECKPJQXJY-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1nc(c(s1)S(=O)(=O)N)C
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.029g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.315g/mol
Monoisotopic Mass:
248.029g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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