Home Halogens Dihydroquinidine 4-chlorobenzoate

Dihydroquinidine 4-chlorobenzoate

CAS No.:
113162-02-0
Catalog Number:
AG003QYT
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$73
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Product Description
Catalog Number:
AG003QYT
Chemical Name:
Dihydroquinidine 4-chlorobenzoate
CAS Number:
113162-02-0
MDL Number:
MFCD00151148
IUPAC Name:
[(S)-[(2R,4S,5S)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl] 4-chlorobenzoate
InChI:
InChI=1S/C27H29ClN2O3/c1-3-17-16-30-13-11-19(17)14-25(30)26(33-27(31)18-4-6-20(28)7-5-18)22-10-12-29-24-9-8-21(32-2)15-23(22)24/h4-10,12,15,17,19,25-26H,3,11,13-14,16H2,1-2H3/t17-,19+,25-,26+/m1/s1
InChI Key:
TXVNNFDXQZFMBQ-XHYUFEOFSA-N
Properties
Complexity:
670  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
464.187g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
464.99g/mol
Monoisotopic Mass:
464.187g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9  
Properties