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

Details

Stereochemistry ACHIRAL
Molecular Formula C24H25ClFN5O2.H2O
Molecular Weight 487.954
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DACOMITINIB

SMILES

O.COC1=C(NC(=O)\C=C\CN2CCCCC2)C=C3C(NC4=CC=C(F)C(Cl)=C4)=NC=NC3=C1

InChI

InChIKey=BSPLGGCPNTZPIH-IPZCTEOASA-N
InChI=1S/C24H25ClFN5O2.H2O/c1-33-22-14-20-17(24(28-15-27-20)29-16-7-8-19(26)18(25)12-16)13-21(22)30-23(32)6-5-11-31-9-3-2-4-10-31;/h5-8,12-15H,2-4,9-11H2,1H3,(H,30,32)(H,27,28,29);1H2/b6-5+;

HIDE SMILES / InChI

Approval Year

Name Type Language
DACOMITINIB
USAN  
USAN  
Official Name English
DACOMITINIB MONOHYDRATE
Common Name English
DACOMITINIB [USAN]
Common Name English
DACOMITINIB HYDRATE [JAN]
Common Name English
DACOMITINIB [ORANGE BOOK]
Common Name English
2-BUTENAMIDE, N-(4-((3-CHLORO-4-FLUOROPHENYL)AMINO)-7-METHOXY-6-QUINAZOLINYL)-4-(1- PIPERIDINYL)-, HYDRATE (1:1), (2E)-
Common Name English
PF-00299804-03
Code English
Dacomitinib monohydrate [WHO-DD]
Common Name English
VIZIMPRO
Brand Name English
(2E)-N-(4-(3-CHLORO-4-FLUOROPHENYL)AMINO)7-METHOXYQUINAZOLIN-6-YL)4-(PIPERIDIN-1-YL)BUT-2-ENAMIDE MONOHYDRATE
Common Name English
DACOMITINIB [MI]
Common Name English
Classification Tree Code System Code
WHO-ATC L01XE47
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
FDA ORPHAN DRUG 435114
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
NCI_THESAURUS C2167
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
NCI_THESAURUS C129825
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
Code System Code Type Description
EVMPD
SUB191069
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
DAILYMED
5092U85G58
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
LACTMED
Dacomitinib
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
CAS
1042385-75-0
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
EPA CompTox
DTXSID80146359
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
RXCUI
2058849
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
NCI_THESAURUS
C53398
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
WIKIPEDIA
Dacomitinib
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110732
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
MERCK INDEX
m12088
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
DRUG BANK
DB11963
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
FDA UNII
5092U85G58
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
CHEBI
132268
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
PUBCHEM
70693519
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
USAN
WW-138
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
SMS_ID
100000176290
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY
DRUG CENTRAL
5297
Created by admin on Fri Dec 15 15:40:47 UTC 2023 , Edited by admin on Fri Dec 15 15:40:47 UTC 2023
PRIMARY