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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H27N2O5S.Na
Molecular Weight 490.547
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EVATANEPAG SODIUM

SMILES

[Na+].CC(C)(C)C1=CC=C(CN(CC2=CC(OCC([O-])=O)=CC=C2)S(=O)(=O)C3=CN=CC=C3)C=C1

InChI

InChIKey=SVNBMCJEDANCKY-UHFFFAOYSA-M
InChI=1S/C25H28N2O5S.Na/c1-25(2,3)21-11-9-19(10-12-21)16-27(33(30,31)23-8-5-13-26-15-23)17-20-6-4-7-22(14-20)32-18-24(28)29;/h4-15H,16-18H2,1-3H3,(H,28,29);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C25H27N2O5S
Molecular Weight 467.557
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Evatanepag (CP-533,536) is a prostaglandin E2 EP2 receptor agonist. It stimulates new bone formation on trabecular, endocortical, and periosteal surfaces and enhances fracture healing. Evatanepag was under development with Pfizer as a bone formation stimulant for therapeutic use in the healing of fractures.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
5.0 nM [EC50]
PubMed

PubMed

TitleDatePubMed
In vitro pharmacological characterization of CJ-042794, a novel, potent, and selective prostaglandin EP(4) receptor antagonist.
2008 Jan 16
CYP2C8- and CYP3A-mediated C-demethylation of (3-{[(4-tert-butylbenzyl)-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid (CP-533,536), an EP2 receptor-selective prostaglandin E2 agonist: characterization of metabolites by high-resolution liquid chromatography-tandem mass spectrometry and liquid chromatography/mass spectrometry-nuclear magnetic resonance.
2008 Oct
Discovery of CP-533536: an EP2 receptor selective prostaglandin E2 (PGE2) agonist that induces local bone formation.
2009 Apr 1
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:42:25 UTC 2023
Edited
by admin
on Fri Dec 15 15:42:25 UTC 2023
Record UNII
U6GMO13KCQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EVATANEPAG SODIUM
USAN  
USAN  
Official Name English
CP-533,536-02
Code English
Sodium 2-(3-{[{[4-(1,1-dimethylethyl)phenyl]methyl}(pyridin-3-ylsulfonyl)amino]methyl}phenoxy)acetate
Systematic Name English
C-533536-02
Code English
CP-533536-02
Code English
EVATANEPAG SODIUM [USAN]
Common Name English
ACETIC ACID, 2-(3-((((4-(1,1-DIMETHYLETHYL)PHENYL)METHYL)(3-PYRIDINYLSULFONYL)AMINO)METHYL)PHENOXY)-, SODIUM SALT (1:1)
Systematic Name English
C-533,536-02
Code English
C-53353602
Code English
Classification Tree Code System Code
NCI_THESAURUS C78568
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
Code System Code Type Description
SMS_ID
300000044595
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
CAS
223490-49-1
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
DRUG BANK
DBSALT002124
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
PUBCHEM
23674101
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
NCI_THESAURUS
C83708
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID40945002
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
ChEMBL
CHEMBL563646
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
FDA UNII
U6GMO13KCQ
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
USAN
UU-104
Created by admin on Fri Dec 15 15:42:25 UTC 2023 , Edited by admin on Fri Dec 15 15:42:25 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY