2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one


Chemical Name: 2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one
CAS Number: 224785-90-4
Product Number: AG00I4FT(AGN-PC-006FSD)
Synonyms:
MDL No: MFCD07773094
Molecular Formula: C23H33ClN6O4S
Molecular Weight: 525.0639

Identification/Properties


Properties
BP:
692.2°C at 760 mmHg
Storage:
Room Temperature;Light sensitive;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
488.607g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
8
Exact Mass:
488.221g/mol
Monoisotopic Mass:
488.221g/mol
Topological Polar Surface Area:
118A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
854
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H373-H410
Precautionary Statements:
P273-P301+P310
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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