1-(4-chlorophenyl)-2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-(trideuteriomethyl)amino]ethanone


Chemical Name: 1-(4-chlorophenyl)-2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-(trideuteriomethyl)amino]ethanone
CAS Number: 23047-25-8
Product Number: AG002M08(AGN-PC-07Y4OV)
Synonyms:
MDL No: MFCD00865465
Molecular Formula: C26H27ClN2O
Molecular Weight: 418.9584

Identification/Properties


Computed Properties
Molecular Weight:
418.965g/mol
XLogP3:
6.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
7
Exact Mass:
418.181g/mol
Monoisotopic Mass:
418.181g/mol
Topological Polar Surface Area:
23.6A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
523
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

Safety Information


NMR Spectrum


Other Analytical Data


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