U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C15H21ClN6.2ClH
Molecular Weight 393.742
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LESOPITRON DIHYDROCHLORIDE

SMILES

Cl.Cl.ClC1=CN(CCCCN2CCN(CC2)C3=NC=CC=N3)N=C1

InChI

InChIKey=RGDLQJUAYQRGBC-UHFFFAOYSA-N
InChI=1S/C15H21ClN6.2ClH/c16-14-12-19-22(13-14)7-2-1-6-20-8-10-21(11-9-20)15-17-4-3-5-18-15;;/h3-5,12-13H,1-2,6-11H2;2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C15H21ClN6
Molecular Weight 320.82
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:57:29 UTC 2023
Edited
by admin
on Fri Dec 15 15:57:29 UTC 2023
Record UNII
4T5L4T8473
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LESOPITRON DIHYDROCHLORIDE
MI  
Common Name English
E-4424
Code English
PYRIMIDINE, 2-(4-(4-(4-CHLORO-1H-PYRAZOL-1-YL)BUTYL)-1-PIPERAZINYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
PYRIMIDINE, 2-(4-(4-(4-CHLORO-1H-PYRAZOL-1-YL)BUTYL)-1-PIPERAZINYL)-, DIHYDROCHLORIDE
Common Name English
LESOPITRON DIHYDROCHLORIDE [MI]
Common Name English
Code System Code Type Description
PUBCHEM
60812
Created by admin on Fri Dec 15 15:57:29 UTC 2023 , Edited by admin on Fri Dec 15 15:57:29 UTC 2023
PRIMARY
CAS
132449-89-9
Created by admin on Fri Dec 15 15:57:29 UTC 2023 , Edited by admin on Fri Dec 15 15:57:29 UTC 2023
PRIMARY
EPA CompTox
DTXSID00157588
Created by admin on Fri Dec 15 15:57:29 UTC 2023 , Edited by admin on Fri Dec 15 15:57:29 UTC 2023
PRIMARY
MERCK INDEX
m6771
Created by admin on Fri Dec 15 15:57:29 UTC 2023 , Edited by admin on Fri Dec 15 15:57:29 UTC 2023
PRIMARY Merck Index
FDA UNII
4T5L4T8473
Created by admin on Fri Dec 15 15:57:29 UTC 2023 , Edited by admin on Fri Dec 15 15:57:29 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE