2-(METHYLTHIO)PYRIDO[4,3-D]PYRIMIDIN-5(6H)-ONE


Chemical Name: 2-(METHYLTHIO)PYRIDO[4,3-D]PYRIMIDIN-5(6H)-ONE
CAS Number: 902576-09-4
Product Number: AG003612(AGN-PC-0WAMJB)
Synonyms:
MDL No:
Molecular Formula: C8H7N3OS
Molecular Weight: 193.2257

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
193.224g/mol
XLogP3:
0.5
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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