5-[[4-[1,1,2,2-tetradeuterio-2-[5-(2-methyl-1,3-dioxolan-2-yl)pyridin-2-yl]ethoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione


Chemical Name: 5-[[4-[1,1,2,2-tetradeuterio-2-[5-(2-methyl-1,3-dioxolan-2-yl)pyridin-2-yl]ethoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
CAS Number: 184766-62-9
Product Number: AG00APL1(AGN-PC-0BSKBV)
Synonyms:
MDL No:
Molecular Formula: C21H20N2O5S
Molecular Weight: 412.4589

Identification/Properties


Computed Properties
Molecular Weight:
412.46g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
6
Exact Mass:
412.109g/mol
Monoisotopic Mass:
412.109g/mol
Topological Polar Surface Area:
112A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
641
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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