MK-5108


Chemical Name: MK-5108
CAS Number: 1010085-13-8
Product Number: AG008TI5(AGN-PC-0WAE64)
Synonyms:
MDL No:
Molecular Formula: C22H21ClFN3O3S
Molecular Weight: 461.9368

Identification/Properties


Computed Properties
Molecular Weight:
461.936g/mol
XLogP3:
5.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
461.098g/mol
Monoisotopic Mass:
461.098g/mol
Topological Polar Surface Area:
113A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
611
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:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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