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13127-21-4

13127-21-4 structural image
Product Name: 3-HYDROXY-5-PHENYL-1,3-DIHYDRO-BENZO[E][1,4]DIAZEPIN-2-ONE
Formula: C15H12N2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >37.8 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 252.27 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 252.089877630 g/mol
Monoisotopic Mass 252.089877630 g/mol
Topological Polar Surface Area 61.7 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 374
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes