2H-3-Benzazepin-2-one,3-[[(3S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-piperidinyl]methyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-, monohydrochloride


Chemical Name: 2H-3-Benzazepin-2-one,3-[[(3S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-piperidinyl]methyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-, monohydrochloride
CAS Number: 186097-54-1
Product Number: AG003PSI(AGN-PC-0QF2OO)
Synonyms:
MDL No:
Molecular Formula: C28H39ClN2O5
Molecular Weight: 519.0727

Identification/Properties


Computed Properties
Molecular Weight:
519.079g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
9
Exact Mass:
518.255g/mol
Monoisotopic Mass:
518.255g/mol
Topological Polar Surface Area:
60.5A^2
Heavy Atom Count:
36
Formal Charge:
0
Complexity:
663
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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