R67KC9COEN
1,1-diethyl-4-phenyl-1,4-diazepan-1-ium;4-methylbenzenesulfonate
Molecular Identity
R67KC9COEN
1,1-diethyl-4-phenyl-1,4-diazepan-1-ium;4-methylbenzenesulfonate
PubChem CID: 117587641
2D Structure
Properties
C22H32N2O3S
Molecular Formula
404.60
Molecular Weight
g/mol
404.2134
Exact Mass
Da
68.8
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
4
H-Bond Acceptors
410
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(11)
R67KC9COEN1609534-90-81H-1,4-Diazepinium, 1,1-diethylhexahydro-4-phenyl-, 4-methylbenzenesulfonate (1:1)RefChem:114530Asm-024UNII-R67KC9COENSCHEMBL18980726GLXC-213311,1-Diethyl-4-phenyl-1,4-diazepan-1-ium tosylateQ272878451,1-Diethyl-4-phenyl-1,4-diazepan-1-ium 4-methylbenzenesulfonate
Data from PubChem (NCBI)
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