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Home > Pyridines > 1260178-71-9
1260178-71-9 | Pyrido[3,4-d]pyrimidin-4(3H)-one, 8-methoxy-
CAS No: 1260178-71-9 Catalog No: AG000QR4 MDL No:MFCD21648261
Product Description
Catalog Number:
AG000QR4
Chemical Name:
Pyrido[3,4-d]pyrimidin-4(3H)-one, 8-methoxy-
CAS Number:
1260178-71-9
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD21648261
IUPAC Name:
8-methoxy-3H-pyrido[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C8H7N3O2/c1-13-8-6-5(2-3-9-8)7(12)11-4-10-6/h2-4H,1H3,(H,10,11,12)
InChI Key:
UAVYDZAGFTYRPF-UHFFFAOYSA-N
SMILES:
COc1nccc2c1nc[nH]c2=O
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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