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Details

Stereochemistry ACHIRAL
Molecular Formula C21H30ClN5O2
Molecular Weight 419.948
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Chloro Buspirone

SMILES

ClC1=CN=C(N=C1)N2CCN(CCCCN3C(=O)CC4(CCCC4)CC3=O)CC2

InChI

InChIKey=IPKKCBWQMPTCKP-UHFFFAOYSA-N
InChI=1S/C21H30ClN5O2/c22-17-15-23-20(24-16-17)26-11-9-25(10-12-26)7-3-4-8-27-18(28)13-21(14-19(27)29)5-1-2-6-21/h15-16H,1-14H2

HIDE SMILES / InChI

Molecular Formula C21H30ClN5O2
Molecular Weight 419.948
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 Mon Mar 31 23:28:01 GMT 2025
Edited
by admin
on Mon Mar 31 23:28:01 GMT 2025
Record UNII
T1W138PH08
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Chloro Buspirone
Common Name English
BUSPIRONE HYDROCHLORIDE IMPURITY I [EP IMPURITY]
Preferred Name English
8-(4-(4-(5-Chloropyrimidin-2-yl)piperazin-1-yl)butyl)-8-azaspiro(4.5)decane-7,9-dione
Systematic Name English
8-[4-[4-(5-Chloro-2-pyrimidinyl)-1-piperazinyl]butyl]-8-azaspiro[4.5]decane-7,9-dione
Systematic Name English
8-Azaspiro[4.5]decane-7,9-dione, 8-[4-[4-(5-chloro-2-pyrimidinyl)-1-piperazinyl]butyl]-
Systematic Name English
CHLOROBUSPIRONE
Common Name English
CHLOROBUSPIRONE [USP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
T1W138PH08
Created by admin on Mon Mar 31 23:28:01 GMT 2025 , Edited by admin on Mon Mar 31 23:28:01 GMT 2025
PRIMARY
CAS
2725354-99-2
Created by admin on Mon Mar 31 23:28:01 GMT 2025 , Edited by admin on Mon Mar 31 23:28:01 GMT 2025
PRIMARY
PUBCHEM
129318579
Created by admin on Mon Mar 31 23:28:01 GMT 2025 , Edited by admin on Mon Mar 31 23:28:01 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
impurity detected at UV 240 nm
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP