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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H28N4O2
Molecular Weight 392.494
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESFLUORO RISPERIDONE

SMILES

CC1=C(CCN2CCC(CC2)C3=NOC4=C3C=CC=C4)C(=O)N5CCCCC5=N1

InChI

InChIKey=PLOGUXWMVNJOPF-UHFFFAOYSA-N
InChI=1S/C23H28N4O2/c1-16-18(23(28)27-12-5-4-8-21(27)24-16)11-15-26-13-9-17(10-14-26)22-19-6-2-3-7-20(19)29-25-22/h2-3,6-7,17H,4-5,8-15H2,1H3

HIDE SMILES / InChI

Molecular Formula C23H28N4O2
Molecular Weight 392.494
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Thu Jul 06 14:39:17 UTC 2023
Edited
by admin
on Thu Jul 06 14:39:17 UTC 2023
Record UNII
00J14P0P46
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESFLUORO RISPERIDONE
Common Name English
RISPERIDONE IMPURITY K [EP IMPURITY]
Common Name English
3-(2-(4-(1,2-BENZISOXAZOL-3-YL)PIPERIDIN-1-YL)ETHYL)-2-METHYL-6,7,8,9-TETRAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE
Systematic Name English
4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE, 3-(2-(4-(1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)ETHYL)-6,7,8,9-TETRAHYDRO-2-METHYL-
Systematic Name English
Code System Code Type Description
CAS
106266-09-5
Created by admin on Thu Jul 06 14:39:17 UTC 2023 , Edited by admin on Thu Jul 06 14:39:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID30147558
Created by admin on Thu Jul 06 14:39:17 UTC 2023 , Edited by admin on Thu Jul 06 14:39:17 UTC 2023
PRIMARY
FDA UNII
00J14P0P46
Created by admin on Thu Jul 06 14:39:17 UTC 2023 , Edited by admin on Thu Jul 06 14:39:17 UTC 2023
PRIMARY
PUBCHEM
14372035
Created by admin on Thu Jul 06 14:39:17 UTC 2023 , Edited by admin on Thu Jul 06 14:39:17 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP