4(1H)-Quinazolinone, 2,3-dihydro-5-methyl-3-phenyl-2-thioxo-


Chemical Name: 4(1H)-Quinazolinone, 2,3-dihydro-5-methyl-3-phenyl-2-thioxo-
CAS Number: 117106-06-6
Product Number: AG000DQT(AGN-PC-001USY)
Synonyms:
MDL No:
Molecular Formula: C15H12N2OS
Molecular Weight: 268.3336

Identification/Properties


Computed Properties
Molecular Weight:
268.334g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
268.067g/mol
Monoisotopic Mass:
268.067g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
378
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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