Home Other Building Blocks Anisotropine Methyl Bromide

Anisotropine Methyl Bromide

CAS No.:
80-50-2
Catalog Number:
AG003NWP
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003NWP
Chemical Name:
Anisotropine Methyl Bromide
CAS Number:
80-50-2
MDL Number:
MFCD00083234
IUPAC Name:
[(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-propylpentanoate;bromide
InChI:
InChI=1S/C17H32NO2.BrH/c1-5-7-13(8-6-2)17(19)20-16-11-14-9-10-15(12-16)18(14,3)4;/h13-16H,5-12H2,1-4H3;1H/q+1;/p-1/t14-,15+,16?;
InChI Key:
QSFKGMJOKUZAJM-JXMYBXCISA-M
EC Number:
201-285-6
UNII:
62M960DHIL
RTECS Number:
YM3710000
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
361.162g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.352g/mol
Monoisotopic Mass:
361.162g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Quantitative structure-activity relationship and complex network approach to monoamine oxidase A and B inhibitors. Journal of medicinal chemistry 20081113
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties