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47326-86-3

47326-86-3 structural image
Product Name: BRL 6231
Formula: C14H18Cl3N5O2
Synonyms: 1,6-Dihydro-6,6-dimethyl-1-[3-(2,4,5-trichlorophenoxy)propoxy]-1,3,5-triazine-2,4-diamine
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COMPUTED DESCRIPTORS

Molecular Weight 394.7 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 393.052608 g/mol
Monoisotopic Mass 393.052608 g/mol
Topological Polar Surface Area 98.5 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 503
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