8-Methoxypyrido[3,4-d]pyrimidin-4(3H)-one


Chemical Name: 8-Methoxypyrido[3,4-d]pyrimidin-4(3H)-one
CAS Number: 1260178-71-9
Product Number: AG000QR4(AGN-PC-0WAMCD)
Synonyms:
MDL No: MFCD21648261
Molecular Formula: C8H7N3O2
Molecular Weight: 177.1601

Identification/Properties


Computed Properties
Molecular Weight:
177.163g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
177.054g/mol
Monoisotopic Mass:
177.054g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
242
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
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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