4-[[(2S,5R)-2,5-dimethyl-4-prop-2-enylpiperazin-1-yl]-phenylmethyl]-N,N-diethylbenzamide


Chemical Name: 4-[[(2S,5R)-2,5-dimethyl-4-prop-2-enylpiperazin-1-yl]-phenylmethyl]-N,N-diethylbenzamide
CAS Number: 178803-51-5
Product Number: AG01E2UA(AGN-PC-073FXM)
Synonyms:
MDL No:
Molecular Formula: C27H37N3O
Molecular Weight: 419.6022

Identification/Properties


Computed Properties
Molecular Weight:
419.613g/mol
XLogP3:
5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
8
Exact Mass:
419.294g/mol
Monoisotopic Mass:
419.294g/mol
Topological Polar Surface Area:
26.8A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
561
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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