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102489-54-3

102489-54-3 | Acetamide, N-(2-chloro-6-methylphenyl)-2-[[2-(diethylamino)ethyl](2-phenoxyethyl)amino]-, hydrochloride (1:1)

CAS No: 102489-54-3 Catalog No: AG0007KX MDL No:

Product Description

Catalog Number:
AG0007KX
Chemical Name:
Acetamide, N-(2-chloro-6-methylphenyl)-2-[[2-(diethylamino)ethyl](2-phenoxyethyl)amino]-, hydrochloride (1:1)
CAS Number:
102489-54-3
Molecular Formula:
C23H33Cl2N3O2
Molecular Weight:
454.4330
IUPAC Name:
2-[[2-(2-chloro-6-methylanilino)-2-oxoethyl]-(2-phenoxyethyl)amino]ethyl-diethylazanium;chloride
InChI:
InChI=1S/C23H32ClN3O2.ClH/c1-4-26(5-2)14-15-27(16-17-29-20-11-7-6-8-12-20)18-22(28)25-23-19(3)10-9-13-21(23)24;/h6-13H,4-5,14-18H2,1-3H3,(H,25,28);1H
InChI Key:
OWGLUEIRSNIQKI-UHFFFAOYSA-N
SMILES:
CCN(CCN(CC(=O)Nc1c(C)cccc1Cl)CCOc1ccccc1)CC.Cl

Properties

Complexity:
455  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
453.195g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
454.436g/mol
Monoisotopic Mass:
453.195g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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