5-[[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride


Chemical Name: 5-[[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride
CAS Number: 10049-83-9
Product Number: AG000245(AGN-PC-0NIHR6)
Synonyms:
MDL No:
Molecular Formula: C16H22Cl2N2O4S2
Molecular Weight: 441.3929

Identification/Properties


Computed Properties
Molecular Weight:
441.382g/mol
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
440.04g/mol
Monoisotopic Mass:
440.04g/mol
Topological Polar Surface Area:
157A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
346
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:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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