2-methylsulfanyl-8H-pyrido[2,3-d]pyrimidin-7-one


Chemical Name: 2-methylsulfanyl-8H-pyrido[2,3-d]pyrimidin-7-one
CAS Number: 211244-81-4
Product Number: AG002L92(AGN-PC-0K2DG8)
Synonyms:
MDL No:
Molecular Formula: C8H7N3OS
Molecular Weight: 193.2257

Identification/Properties


Computed Properties
Molecular Weight:
193.224g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
193.031g/mol
Monoisotopic Mass:
193.031g/mol
Topological Polar Surface Area:
80.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
244
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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