6-benzyl-2,4-dichloro-5H-pyrrolo[3,4-d]pyrimidin-7-one


Chemical Name: 6-benzyl-2,4-dichloro-5H-pyrrolo[3,4-d]pyrimidin-7-one
CAS Number: 1207368-82-8
Product Number: AG0097HV(AGN-PC-0CTG4U)
Synonyms:
MDL No:
Molecular Formula: C13H9Cl2N3O
Molecular Weight: 294.13606

Identification/Properties


Computed Properties
Molecular Weight:
294.135g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
293.012g/mol
Monoisotopic Mass:
293.012g/mol
Topological Polar Surface Area:
46.1A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
349
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

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NMR Spectrum


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