b-D-Glucopyranosiduronic acid,4-[6-hydroxy-3-[4-[2-(1-piperidinyl)ethoxy]benzoyl]benzo[b]thien-2-yl]phenyl


Chemical Name: b-D-Glucopyranosiduronic acid,4-[6-hydroxy-3-[4-[2-(1-piperidinyl)ethoxy]benzoyl]benzo[b]thien-2-yl]phenyl
CAS Number: 182507-22-8
Product Number: AG0023Y6(AGN-PC-0QC7YT)
Synonyms:
MDL No: MFCD00946710
Molecular Formula: C34H35NO10S
Molecular Weight: 649.7074

Identification/Properties


Computed Properties
Molecular Weight:
649.711g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
12
Rotatable Bond Count:
10
Exact Mass:
649.198g/mol
Monoisotopic Mass:
649.198g/mol
Topological Polar Surface Area:
195A^2
Heavy Atom Count:
46
Formal Charge:
0
Complexity:
1010
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
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


NMR Spectrum


Other Analytical Data


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