5-(4-bromophenyl)-3H-thieno[2,3-d]pyrimidin-4-one


Chemical Name: 5-(4-bromophenyl)-3H-thieno[2,3-d]pyrimidin-4-one
CAS Number: 307512-24-9
Product Number: AG00315T(AGN-PC-0JVJF2)
Synonyms:
MDL No:
Molecular Formula: C12H7BrN2OS
Molecular Weight: 307.1658

Identification/Properties


Computed Properties
Molecular Weight:
307.165g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
305.946g/mol
Monoisotopic Mass:
305.946g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
341
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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