Home Other Building Blocks N-Desethyl AModiaquine Dihydrochloride

N-Desethyl AModiaquine Dihydrochloride

CAS No.:
79049-30-2
Catalog Number:
AG00G4UC
Molecular Formula:
C18H20Cl3N3O
Molecular Weight:
400.7299
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$150
- +
5mg
≥95%
1 week
United States
$471
- +
Product Description
Catalog Number:
AG00G4UC
Chemical Name:
N-Desethyl AModiaquine Dihydrochloride
CAS Number:
79049-30-2
Molecular Formula:
C18H20Cl3N3O
Molecular Weight:
400.7299
MDL Number:
MFCD08063715
IUPAC Name:
4-[(7-chloroquinolin-4-yl)amino]-2-(ethylaminomethyl)phenol;dihydrochloride
InChI:
InChI=1S/C18H18ClN3O.2ClH/c1-2-20-11-12-9-14(4-6-18(12)23)22-16-7-8-21-17-10-13(19)3-5-15(16)17;;/h3-10,20,23H,2,11H2,1H3,(H,21,22);2*1H
InChI Key:
BCYBRFGUODDEGH-UHFFFAOYSA-N
SMILES:
CCNCc1cc(ccc1O)Nc1ccnc2c1ccc(c2)Cl.Cl.Cl
Properties
Complexity:
370  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.067g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
400.728g/mol
Monoisotopic Mass:
399.067g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties