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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H22ClF3N6O3
Molecular Weight 582.961
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IVOSIDENIB

SMILES

FC1=CN=CC(=C1)N([C@H](C(=O)NC2CC(F)(F)C2)C3=CC=CC=C3Cl)C(=O)[C@@H]4CCC(=O)N4C5=NC=CC(=C5)C#N

InChI

InChIKey=WIJZXSAJMHAVGX-DHLKQENFSA-N
InChI=1S/C28H22ClF3N6O3/c29-21-4-2-1-3-20(21)25(26(40)36-18-11-28(31,32)12-18)37(19-10-17(30)14-34-15-19)27(41)22-5-6-24(39)38(22)23-9-16(13-33)7-8-35-23/h1-4,7-10,14-15,18,22,25H,5-6,11-12H2,(H,36,40)/t22-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H22ClF3N6O3
Molecular Weight 582.961
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:49:08 UTC 2023
Edited
by admin
on Sat Dec 16 10:49:08 UTC 2023
Record UNII
Q2PCN8MAM6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IVOSIDENIB
INN   USAN   WHO-DD  
INN   USAN  
Official Name English
TIBSOVO
Brand Name English
GLYCINAMIDE, 1-(4-CYANO-2-PYRIDINYL)-5-OXO-L-PROLYL-2-(2-CHLOROPHENYL)-N-(3,3-DIFLUOROCYCLOBUTYL)-N2-(5-FLUORO-3-PYRIDINYL)-, (2S)-
Systematic Name English
IVOSIDENIB [USAN]
Common Name English
AG-120
Code English
ivosidenib [INN]
Common Name English
IVOSIDENIB [MI]
Common Name English
Ivosidenib [WHO-DD]
Common Name English
IVOSIDENIB [ORANGE BOOK]
Common Name English
(2S)-N-{(1S)-1-(2-Chlorophenyl)-2-[(3,3-difluorocyclobutyl)amino]-2-oxoethyl}-1-(4-cyanopyridin-2-yl)-N-(5-fluoropyridin-3-yl)-5-oxopyrrolidine-2-carboxamide
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 562216
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
FDA ORPHAN DRUG 739720
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
FDA ORPHAN DRUG 938423
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
FDA ORPHAN DRUG 637718
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
EU-Orphan Drug EU/3/16/1802
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
NCI_THESAURUS C137826
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
FDA ORPHAN DRUG 481515
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
Code System Code Type Description
CAS
1448347-49-6
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
DRUG BANK
DB14568
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
WIKIPEDIA
Ivosidenib
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
DAILYMED
Q2PCN8MAM6
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
PUBCHEM
71657455
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
FDA UNII
Q2PCN8MAM6
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
CHEBI
145430
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
INN
10225
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
RXCUI
2049873
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
MERCK INDEX
m12089
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
SMS_ID
100000175066
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
LACTMED
Ivosidenib
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
NCI_THESAURUS
C114383
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
USAN
EF-21
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
DRUG CENTRAL
5292
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID801027928
Created by admin on Sat Dec 16 10:49:08 UTC 2023 , Edited by admin on Sat Dec 16 10:49:08 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
IC50
METABOLIC ENZYME -> INDUCER
The following dose modifications are recommended: Strong CYP3A inducers: Avoid concomitant use.
EXCRETED UNCHANGED
FECAL
TARGET -> INHIBITOR
IC50
TARGET -> INHIBITOR
IC50
TARGET -> INHIBITOR
IC50
EXCRETED UNCHANGED
URINE
METABOLIC ENZYME -> INHIBITOR
The following dose modifications are recommended: Strong CYP3A inhibitors: Reduce dose to 250 mg QD
TRANSPORTER -> SUBSTRATE
TARGET -> INHIBITOR
IC50
BINDER->LIGAND
TARGET -> INHIBITOR
IC50
METABOLIC ENZYME -> SUBSTRATE
The following dose modifications are recommended: Sensitive CYP3A substrates: Avoid concomitant use.
MAJOR
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Tmax PHARMACOKINETIC
Biological Half-life PHARMACOKINETIC
Volume of Distribution PHARMACOKINETIC