E-5842

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H21FN4.C6H8O7
Molecular Weight	492.4974
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.FC1=CC=C(C=C1)C2=CCN(CCCCN3C=NC=N3)CC2

InChI

InChIKey=LTBKOSQVBVYJKW-UHFFFAOYSA-N

InChI=1S/C17H21FN4.C6H8O7/c18-17-5-3-15(4-6-17)16-7-11-21(12-8-16)9-1-2-10-22-14-19-13-20-22;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-7,13-14H,1-2,8-12H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C6H8O7
Molecular Weight	192.1235
Charge	0
Count

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

Molecular Formula	C17H21FN4
Molecular Weight	300.3738
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Fibroblast growth factor-2 is selectively modulated in the rat brain by E-5842, a preferential sigma-1 receptor ligand and putative atypical antipsychotic.	2001-03	11264663

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:47:30 GMT 2025` Edited by `admin` on `Mon Mar 31 22:47:30 GMT 2025`
Record UNII	RSQ93DYX4X
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PYRIDINE, 4-(4-FLUOROPHENYL)-1,2,3,6-TETRAHYDRO-1-(4-(1H-1,2,4-TRIAZOL-1-YL)BUTYL)-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)

Preferred Name

English

E-5842

Code

English

1-(4-(1H-1,2,4-TRIAZOL-1-YL)BUTYL)-4-(4-FLUOROPHENYL)-1,2,3,6-TETRAHYDROPYRIDINE 2-HYDROXYPROPANE-1,2,3-TRICARBOXYLATE

Systematic Name

English

E5842

Code

English

E-5842 CITRATE

Common Name

English

4-(4-FLUOROPHENYL)-1,2,3,6-TETRAHYDRO-1-(4-(1H-1,2,4-TRIAZOL-1-YL)BUTYL)PYRIDINE 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

220120-14-9

Created by admin on Mon Mar 31 22:47:30 GMT 2025 , Edited by admin on Mon Mar 31 22:47:30 GMT 2025

PRIMARY

FDA UNII

RSQ93DYX4X

Created by admin on Mon Mar 31 22:47:30 GMT 2025 , Edited by admin on Mon Mar 31 22:47:30 GMT 2025

PRIMARY

PUBCHEM

6918385

Created by admin on Mon Mar 31 22:47:30 GMT 2025 , Edited by admin on Mon Mar 31 22:47:30 GMT 2025

PRIMARY

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