[1-methyl-3-(1-methylpiperidin-4-yl)indol-5-yl] 2,6-difluorobenzenesulfonate;oxaldehydic acid


Chemical Name: [1-methyl-3-(1-methylpiperidin-4-yl)indol-5-yl] 2,6-difluorobenzenesulfonate;oxaldehydic acid
CAS Number: 445441-27-0
Product Number: AG00DGST(AGN-PC-0JEKO6)
Synonyms:
MDL No: MFCD18384957
Molecular Formula: C23H24F2N2O7S
Molecular Weight: 510.5077

Identification/Properties


Computed Properties
Molecular Weight:
494.51g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
5
Exact Mass:
494.132g/mol
Monoisotopic Mass:
494.132g/mol
Topological Polar Surface Area:
114A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
711
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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