6-methyl-3H-thieno[2,3-d]pyrimidin-4-one


Chemical Name: 6-methyl-3H-thieno[2,3-d]pyrimidin-4-one
CAS Number: 108831-66-9
Product Number: AG007TZF(AGN-PC-0JVNKF)
Synonyms:
MDL No:
Molecular Formula: C7H6N2OS
Molecular Weight: 166.2003

Identification/Properties


Computed Properties
Molecular Weight:
166.198g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
166.02g/mol
Monoisotopic Mass:
166.02g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
217
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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