Thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione


Chemical Name: Thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
CAS Number: 16233-51-5
Product Number: AG001T0J(AGN-PC-0LWG60)
Synonyms:
MDL No: MFCD09909655
Molecular Formula: C6H4N2O2S
Molecular Weight: 168.1732

Identification/Properties


Properties
MP:
102.9°C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
168.17g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
167.999g/mol
Monoisotopic Mass:
167.999g/mol
Topological Polar Surface Area:
86.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
219
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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