4(1H)-Quinazolinone, 3-(4-bromophenyl)-2,3-dihydro-2-thioxo-


Chemical Name: 4(1H)-Quinazolinone, 3-(4-bromophenyl)-2,3-dihydro-2-thioxo-
CAS Number: 1028-39-3
Product Number: AG0086A4(AGN-PC-0JW4LB)
Synonyms:
MDL No:
Molecular Formula: C14H9BrN2OS
Molecular Weight: 333.2031

Identification/Properties


Computed Properties
Molecular Weight:
333.203g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
331.962g/mol
Monoisotopic Mass:
331.962g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
382
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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