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(±)-Desethylchloroquine

(±)-Desethylchloroquine structure

CAS No:
1476-52-4
Formula:
C16H22ClN3
Chemical Name:
(±)-Desethylchloroquine
Synonyms:
1,4-Pentanediamine,N4-(7-chloro-4-quinolinyl)-N1-ethyl-;Quinoline,7-chloro-4-[[4-(ethylamino)-1-methylbutyl]amino]-;N4-(7-Chloro-4-quinolinyl)-N1-ethyl-1,4-pentanediamine;Chloroquine,deethyl-;Deethylchloroquine;N-Deethylchloroquine;4-[[1-Methyl-4-((ethylamino)butyl]amino)]-7-chloroquinoline;Desethylchloroquine;WR 29623;Monodesethylchloroquine;7-Chloro-4-(4-N-ethylamino-1-methylbutylamino)quinoline;Monodeethylchloroquine;(±)-Desethylchloroquine;NSC 13254;1,4-Pentanediamine N4-(7-chloro-4-quinolinyl)-N1-ethyl-;137360-13-5
Categories:
Analytical Chemistry > Standard

Description

Desethyl chloroquine is a major desethyl metabolite of Chloroquine. Chloroquine diphosphate is an inhibitor of autophagy and toll-like receptors (TLRs). Desethyl chloroquine possesses antiplasmodic activity[1][2].

Solid

Desethylchloroquine is an aminoquinoline.

(±)-Desethylchloroquine Basic Attributes

Molecular Weight：

291.82

Exact Mass：

291.82

NSC Number：

13254

HScode：

2933499090

Characteristics

PSA：

XLogP3：

4.54220

Appearance：

Solid

Density：

1.138g/cm3

Melting Point：

100-102 °C

Boiling Point：

173-175 °C @ Press: 0.05 Torr

Flash Point：

227ºC

Refractive Index：

1.602

Storage Conditions：

-20°C Freezer

Vapor Pressure：

2.38E-08mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

Drug Information

MeSH Entry Terms：

deethylchloroquine

(±)-Desethylchloroquine Use and Manufacturing

The major product of the stereoselective human metabolism of Chloroquine, used for the therapy and prevention of malaria

Computed Properties

Molecular Weight:291.82
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:291.1502254
Monoisotopic Mass:291.1502254
Topological Polar Surface Area:37
Heavy Atom Count:20
Complexity:274
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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DESETHYL CHLOROQUINE

CAS No.: 1476-52-4

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