4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE
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4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE
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CAS No:
159860-31-8
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Formula:
C28H41N3O2
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Chemical Name:
4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE
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Synonyms:
4-[(AR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DIMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE;4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE;SNC 121;4-((aR)-a-((2S,5R)-4-Propyl-2,5-dimethyl-1-piperazinyl)-3-methoxybenzyl)-N,N-diethylbenzamide;4-[(alphaR)-alpha-((2S,5R)-4-Propyl-2,5-dimethyl-1-piperazinyl)-3-methoxybenzyl]-N,N-diethylbenzamide;4-[(αR)-α-((2S,5R)-4-Propyl-2,5-dimethyl-1-piperazinyl)-3-methoxybenzyl]-N,N-diethylbenzamide;SNC 121 Dihydrochloride
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CAS No:
4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE Basic Attributes
451.64
451.32
Characteristics
36
5.2
1.033±0.06 g/cm3(Predicted)
566.6±50.0 °C(Predicted)
296.5ºC
1.538
Store at RT
7.37E-13mmHg at 25°C
4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE Use and Manufacturing
Saturated analog of the potent and selective δ opioid receptor agonist SNC 80 ((+)-4-[(aR)-a-((2S,5R)-4-Allyl-2,5-dimethyl-1-piperazinyl)-3-methoxybenzyl]-N,N-diethylbenzamide ), with a similar binding profile to the parent compound.
Computed Properties
Molecular Weight:451.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:451.31987756
Monoisotopic Mass:451.31987756
Topological Polar Surface Area:36
Heavy Atom Count:33
Complexity:588
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
4-[(ALPHAR)-ALPHA-((2S,5R)-4-PROPYL-2,5-DEMETHYL-1-PIPERAZINYL)-3-METHOXYBENZYL]-N,N-DIETHYLBENZAMIDE
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