2-[(2-Chloroethyl)propylamino]ethyl α-hydroxy-α-phenylbenzeneacetate
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2-[(2-Chloroethyl)propylamino]ethyl α-hydroxy-α-phenylbenzeneacetate
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CAS No:
36167-80-3
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Formula:
C21H26ClNO3
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Chemical Name:
2-[(2-Chloroethyl)propylamino]ethyl α-hydroxy-α-phenylbenzeneacetate
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Synonyms:
Benzeneacetic acid,α-hydroxy-α-phenyl-,2-[(2-chloroethyl)propylamino]ethyl ester;2-[(2-Chloroethyl)propylamino]ethyl α-hydroxy-α-phenylbenzeneacetate;Propylbenzilylcholine mustard;N-2′-Chloroethyl-N-propyl-2-aminoethyl benzilate
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CAS No:
Description
An analog of benzilylcholine mustard. It is an alkylating nitrogen mustard analog that binds specifically and irreversibly to cholinergic muscarinic receptors and is used as an affinity label to isolate and study the receptors.
2-[(2-Chloroethyl)propylamino]ethyl α-hydroxy-α-phenylbenzeneacetate Basic Attributes
375.9 g/mol
375.89
0056KS5787
DTXSID90189732
Drug Information
Analogs of those substrates or compounds which bind naturally at the active sites of proteins, enzymes, antibodies, steroids, or physiological receptors. These analogs form a stable covalent bond at the binding site, thereby acting as inhibitors of the proteins or steroids. (See all compounds classified as Affinity Labels.)|Drugs that bind to but do not activate MUSCARINIC RECEPTORS, thereby blocking the actions of endogenous ACETYLCHOLINE or exogenous agonists. Muscarinic antagonists have widespread effects including actions on the iris and ciliary muscle of the eye, the heart and blood vessels, secretions of the respiratory tract, GI system, and salivary glands, GI motility, urinary bladder tone, and the central nervous system. (See all compounds classified as Muscarinic Antagonists.)
Mustard, Propylbenzilylcholine
Computed Properties
Molecular Weight:375.9
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:11
Exact Mass:375.1601214
Monoisotopic Mass:375.1601214
Topological Polar Surface Area:49.8
Heavy Atom Count:26
Complexity:388
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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