CHLOROQUINE SULFATE MONOHYDRATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H26ClN3.H2O.H2O4S
Molecular Weight	435.966
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CHLOROQUINE SULFATE MONOHYDRATE

Structure Search

SMILES

O.OS(O)(=O)=O.CCN(CC)CCCC(C)NC1=CC=NC2=CC(Cl)=CC=C12

InChI

InChIKey=XUPMECJTEQRJMD-UHFFFAOYSA-N

InChI=1S/C18H26ClN3.H2O4S.H2O/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;1-5(2,3)4;/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);(H2,1,2,3,4);1H2

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C18H26ClN3
Molecular Weight	319.872
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:15:22 UTC 2023` Edited by `admin` on `Fri Dec 15 19:15:22 UTC 2023`
Record UNII	JY8ZAE6NTY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHLOROQUINE SULFATE MONOHYDRATE

Common Name

English

1,4-PENTANEDIAMINE, N4-(7-CHLORO-4-QUINOLINYL)-N1,N1-DIETHYL-, SULFATE, HYDRATE (1:1:1)

Systematic Name

English

QUINOLINE, 7-CHLORO-4-((4-(DIETHYLAMINO)-1-METHYLBUTYL)AMINO)-, SULFATE (1:1), MONOHYDRATE

Common Name

English

CHLOROQUINI SULFAS [WHO-IP LATIN]

Common Name

English

CHLOROQUINE SULFATE [WHO-IP]

Common Name

English

Code System Code Type Description

WHO INTERNATIONAL PHARMACOPEIA

CHLOROQUINE SULFATE MONOHYDRATE

Created by admin on Fri Dec 15 19:15:22 UTC 2023 , Edited by admin on Fri Dec 15 19:15:22 UTC 2023

PRIMARY

Description: A white or almost white, crystalline powder; odourless.Solubility: Soluble in 3 parts of water; practically insoluble in ethanol (~750 g/l) TS; sparingly soluble in ether R.Category: Antimalarial.Storage: Chloroquine sulfate should be kept in a well-closed container protected from light.

FDA UNII

JY8ZAE6NTY

Created by admin on Fri Dec 15 19:15:22 UTC 2023 , Edited by admin on Fri Dec 15 19:15:22 UTC 2023

PRIMARY

PUBCHEM

118799019

Created by admin on Fri Dec 15 19:15:22 UTC 2023 , Edited by admin on Fri Dec 15 19:15:22 UTC 2023

PRIMARY

CAS

6823-83-2

Created by admin on Fri Dec 15 19:15:22 UTC 2023 , Edited by admin on Fri Dec 15 19:15:22 UTC 2023

PRIMARY

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Comments:

Molecular formula. C18H26ClN3,H2SO4,H2O