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Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1)

Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1) structure

CAS No:
115199-84-3
Formula:
C21H24Cl2N2O.ClH
Chemical Name:
Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1)
Synonyms:
Benzeneacetamide,3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-,hydrochloride (1:1);Benzeneacetamide,3,4-dichloro-N-methyl-N-[1-phenyl-2-(1-pyrrolidinyl)ethyl]-,monohydrochloride,(S)-;Benzeneacetamide,3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-,monohydrochloride;ICI 199441

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Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1) Basic Attributes

Molecular Weight：

427.8

Exact Mass：

426.10300

UNII：

CT5E310AJL

Characteristics

PSA：

23.6

XLogP3：

5.57130

Boiling Point：

532.8ºC at 760mmHg

Flash Point：

276ºC

Storage Conditions：

Store at RT

Drug Information

MeSH Entry Terms：

ICI 199,441

Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1) Use and Manufacturing

Highly potent κ agonist, 146-fold more active than U-50488 (trans-(-3,4-Dichloro-N-methyl-N-[2-(1-pyrrolidinyl)cyclohexyl]benzeneacetamide hydrochloride ) in vitro .

Computed Properties

Molecular Weight:427.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:426.103247
Monoisotopic Mass:426.103247
Topological Polar Surface Area:23.6
Heavy Atom Count:27
Complexity:449
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1)

Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Benzeneacetamide, 3,4-dichloro-N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]-, hydrochloride (1:1)

SDS

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