2-benzyl-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylic acid


Chemical Name: 2-benzyl-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylic acid
CAS Number: 421562-28-9
Product Number: AG00I86K(AGN-00I810)
Synonyms:
MDL No:
Molecular Formula: C15H12N2O3S
Molecular Weight: 300.3324

Identification/Properties


Computed Properties
Molecular Weight:
300.332g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
300.057g/mol
Monoisotopic Mass:
300.057g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
474
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


NMR Spectrum


Other Analytical Data


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