3-[2-[4-(3,4-dimethylphenyl)piperazin-1-yl]ethyl]-2,3-dihydroisoindol-1-one;dihydrochloride


Chemical Name: 3-[2-[4-(3,4-dimethylphenyl)piperazin-1-yl]ethyl]-2,3-dihydroisoindol-1-one;dihydrochloride
CAS Number: 210688-56-5
Product Number: AG002KWM(AGN-PC-0BLCOV)
Synonyms:
MDL No: MFCD12828776
Molecular Formula: C22H27N3O
Molecular Weight: 349.4693

Identification/Properties


Computed Properties
Molecular Weight:
422.394g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
421.169g/mol
Monoisotopic Mass:
421.169g/mol
Topological Polar Surface Area:
35.6A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
488
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:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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