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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H30N6O2
Molecular Weight 446.5447
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ERDAFITINIB

SMILES

COC1=CC(=CC(OC)=C1)N(CCNC(C)C)C2=CC=C3N=CC(=NC3=C2)C4=CN(C)N=C4

InChI

InChIKey=OLAHOMJCDNXHFI-UHFFFAOYSA-N
InChI=1S/C25H30N6O2/c1-17(2)26-8-9-31(20-10-21(32-4)13-22(11-20)33-5)19-6-7-23-24(12-19)29-25(15-27-23)18-14-28-30(3)16-18/h6-7,10-17,26H,8-9H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C25H30N6O2
Molecular Weight 446.5447
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 Sat Dec 16 17:24:38 UTC 2023
Edited
by admin
on Sat Dec 16 17:24:38 UTC 2023
Record UNII
890E37NHMV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ERDAFITINIB
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
PAN-FGFR TYROSINE KINASE INHIBITOR JNJ-42756493
Common Name English
BALVERSA
Brand Name English
ERDAFITINIB [MI]
Common Name English
ERDAFITINIB [ORANGE BOOK]
Common Name English
ERDAFITINIB [JAN]
Common Name English
erdafitinib [INN]
Common Name English
ERDAFITINIB [USAN]
Common Name English
Erdafitinib [WHO-DD]
Common Name English
JNJ-42756493
Code English
1,2-ETHANEDIAMINE, N1-(3,5-DIMETHOXYPHENYL)-N2-(1-METHYLETHYL)-N1-(3-(1-METHYL-1H-PYRAZOL-4-YL)-6-QUINOXALINYL)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C1967
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
NCI_THESAURUS C129825
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C103273
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
DRUG CENTRAL
5327
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
CAS
1346242-81-6
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
WIKIPEDIA
Erdafitinib
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
MERCK INDEX
m12171
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
INN
10147
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
EPA CompTox
DTXSID001027936
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
DAILYMED
890E37NHMV
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
ChEMBL
CHEMBL3545376
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
DRUG BANK
DB12147
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
FDA UNII
890E37NHMV
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
USAN
DE-47
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
RXCUI
2123125
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
CAS
1620332-47-9
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
NO STRUCTURE GIVEN
SMS_ID
100000177214
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
PUBCHEM
67462786
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
LACTMED
Erdafitinib
Created by admin on Sat Dec 16 17:24:39 UTC 2023 , Edited by admin on Sat Dec 16 17:24:39 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
IC50
EXCRETED UNCHANGED
URINE
TARGET -> INHIBITOR
IC50
BINDER->LIGAND
primarily to alpha-1-acid glycoprotein.
BINDING
TARGET -> INHIBITOR
IC50
TRANSPORTER -> INHIBITOR
TRANSPORTER -> SUBSTRATE
EXCRETED UNCHANGED
FECAL
METABOLIC ENZYME -> SUBSTRATE
CYP3A4 in the total clearance of erdafitinib is estimated to be 20%.
METABOLIC ENZYME -> SUBSTRATE
Contribution of CYP2C9 to the total clearance of erdafitinib is estimated to be 39%
TARGET -> INHIBITOR
IC50
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Biological Half-life PHARMACOKINETIC
Volume of Distribution PHARMACOKINETIC
Tmax PHARMACOKINETIC