(2R)-2-(3,4-dimethoxyphenyl)-5-[2-(4-hydroxy-3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile


Chemical Name: (2R)-2-(3,4-dimethoxyphenyl)-5-[2-(4-hydroxy-3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile
CAS Number: 77326-93-3
Product Number: AG008N9Q(AGN-PC-05J2XH)
Synonyms:
MDL No:
Molecular Formula: C26H36N2O4
Molecular Weight: 440.5750

Identification/Properties


Computed Properties
Molecular Weight:
440.584g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
12
Exact Mass:
440.268g/mol
Monoisotopic Mass:
440.268g/mol
Topological Polar Surface Area:
75A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
592
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

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NMR Spectrum


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