methyl 4-[2-(4-benzylpiperazin-1-yl)ethoxy]benzoate


Chemical Name: methyl 4-[2-(4-benzylpiperazin-1-yl)ethoxy]benzoate
CAS Number: 937601-91-7
Product Number: AG00IHSS(AGN-PC-01XG41)
Synonyms:
MDL No:
Molecular Formula: C21H26N2O3
Molecular Weight: 354.4427

Identification/Properties


Computed Properties
Molecular Weight:
354.45g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
8
Exact Mass:
354.194g/mol
Monoisotopic Mass:
354.194g/mol
Topological Polar Surface Area:
42A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
410
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

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NMR Spectrum


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