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338957-56-5

338957-56-5 structural image
Product Name: 2-[(BUTYLSULFANYL)METHYL]-6,8-DICHLORO-3-(2,6-DIMETHYLPHENYL)-4(3H)-QUINAZOLINONE
Formula: C21H22Cl2N2OS
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COMPUTED DESCRIPTORS

Molecular Weight 421.4 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 420.0829899 g/mol
Monoisotopic Mass 420.0829899 g/mol
Topological Polar Surface Area 58 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 548
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