AC1Q1RBB

(2-chlorophenyl)methyl-diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium bromide

Also Known As: ZH-112|methyl-diethyl-[carbamoylmethyl]azaniumbromide|Benzenemethanaminium, 2-chloro-N,N-diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-, bromide|(2-chlorophenyl)methyl-diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium bromide|(2-chlorophenyl)methyl-diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium,bromide|(2-chlorophenyl)methyl-diethyl-[2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium bromide|Benzenemethanaminium,2-chloro-N,N-diethyl-N-[2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl]-, bromide(1:1)

Molecular Formula	C22H30BrClN2O
Molecular Weight	452.123 g/mol
LogP	2.26456
Topological Polar Surface Area	29.1 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	1
Rotatable Bonds	7
Exact Mass	452.123
Monoisotopic Mass	452.123
Heavy Atoms	27
Complexity	764.6274

Chemical Identifiers

CAS Number	79154-29-3
SMILES	CC[N+](CC)(CC1=CC=CC=C1Cl)CC(=O)NC2=C(C=C(C=C2C)C)C.[Br-]