Home Sulfos Benzenesulfonamide, 4-amino-N-(2,6-dimethoxy-4-pyrimidinyl)-,monosodium salt

Benzenesulfonamide, 4-amino-N-(2,6-dimethoxy-4-pyrimidinyl)-,monosodium salt

CAS No.:
1037-50-9
Catalog Number:
AG00HA5Y
Molecular Formula:
C12H13N4NaO4S
Molecular Weight:
332.3108
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Product Description
Catalog Number:
AG00HA5Y
Chemical Name:
Benzenesulfonamide, 4-amino-N-(2,6-dimethoxy-4-pyrimidinyl)-,monosodium salt
CAS Number:
1037-50-9
Molecular Formula:
C12H13N4NaO4S
Molecular Weight:
332.3108
MDL Number:
MFCD00070155
IUPAC Name:
sodium;(4-aminophenyl)sulfonyl-(2,6-dimethoxypyrimidin-4-yl)azanide
InChI:
InChI=1S/C12H13N4O4S.Na/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9;/h3-7H,13H2,1-2H3;/q-1;+1
InChI Key:
DQDZQHMCPDUUPC-UHFFFAOYSA-N
SMILES:
COc1nc(OC)nc(c1)[N-]S(=O)(=O)c1ccc(cc1)N.[Na+]
EC Number:
213-859-3
UNII:
49DG2B481W
Properties
Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.056g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
332.31g/mol
Monoisotopic Mass:
332.056g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties