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735336-28-4

735336-28-4 structural image
Product Name: 4-Piperidinecarboxylic acid, 1-[2-[[3,4-dihydro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetyl]-
Formula: C23H23N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 437.5 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 437.14092740 g/mol
Monoisotopic Mass 437.14092740 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 714
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