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115781-40-3 | Sulfamic acid, N-(3,8-dimethyl-3H-imidazo[4,5-f]quinoxalin-2-yl)-
CAS No: 115781-40-3 Catalog No: AG000GUL MDL No:
Product Description
Catalog Number:
AG000GUL
Chemical Name:
Sulfamic acid, N-(3,8-dimethyl-3H-imidazo[4,5-f]quinoxalin-2-yl)-
CAS Number:
115781-40-3
Molecular Formula:
C11H11N5O3S
Molecular Weight:
293.3017
IUPAC Name:
(3,8-dimethylimidazo[4,5-f]quinoxalin-2-yl)sulfamic acid
InChI:
InChI=1S/C11H11N5O3S/c1-6-5-12-7-3-4-8-10(9(7)13-6)14-11(16(8)2)15-20(17,18)19/h3-5H,1-2H3,(H,14,15)(H,17,18,19)
InChI Key:
CGJDLJCQPGFMKQ-UHFFFAOYSA-N
SMILES:
Cc1cnc2c(n1)c1nc(n(c1cc2)C)NS(=O)(=O)O
UNII:
70032N3D6L
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.058g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
293.301g/mol
Monoisotopic Mass:
293.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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