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

Details

Stereochemistry RACEMIC
Molecular Formula C29H36N2O9
Molecular Weight 556.6041
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CINEPAXADIL

SMILES

COC1=CC(\C=C\C(=O)N2CCN(CC(O)COC3=CC=C(C(C)=O)C4=C3OCCO4)CC2)=CC(OC)=C1OC

InChI

InChIKey=SYFDPNLESAYNCB-VMPITWQZSA-N
InChI=1S/C29H36N2O9/c1-19(32)22-6-7-23(29-27(22)38-13-14-39-29)40-18-21(33)17-30-9-11-31(12-10-30)26(34)8-5-20-15-24(35-2)28(37-4)25(16-20)36-3/h5-8,15-16,21,33H,9-14,17-18H2,1-4H3/b8-5+

HIDE SMILES / InChI

Molecular Formula C29H36N2O9
Molecular Weight 556.6041
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Cinepaxadil is cinnamoyl-piperazine derivative developed by Delalande SA for treatment cardiovascular system disorders. Cinepaxadil decrease dogs cardiac activity after i.v. administration.

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Sample Use Guides

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:24:05 GMT 2023
Edited
by admin
on Fri Dec 15 16:24:05 GMT 2023
Record UNII
E052L8N506
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CINEPAXADIL
INN  
INN  
Official Name English
cinepaxadil [INN]
Common Name English
.ALPHA.-(((8-ACETYL-1,4-BENZODIOXAN-5-YL)OXY)METHYL)-4-(3,4,5-TRIMETHOXYCINNAMOYL)-1-PIPERAZINEETHANOL
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29707
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
Code System Code Type Description
PUBCHEM
6436099
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
CAS
69118-25-8
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
INN
5372
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
NCI_THESAURUS
C90999
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
FDA UNII
E052L8N506
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID70867804
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
SMS_ID
100000081042
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
ECHA (EC/EINECS)
273-876-7
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104490
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
EVMPD
SUB06290MIG
Created by admin on Fri Dec 15 16:24:05 GMT 2023 , Edited by admin on Fri Dec 15 16:24:05 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY