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dacomitinib

CHEBI:CHEBI_132268

Definition

A member of the class of quinazolines that is 7-methoxyquinazoline-4,6-diamine in which the amino group at position 4 is substituted by a 3-chloro-4-fluorophenyl group and the amino group at position 6 is substituted by an (E)-4-(piperidin-1-yl)but-2-enoyl group.

Chemical Information

Molecular Formula
C24H25ClFN5O2
Molecular Mass
469.940
Charge
0
SMILES
ClC=1C=C(NC2=NC=NC=3C2=CC(NC(=O)\C=C\CN4CCCCC4)=C(OC)C3)C=CC1F
InChI
InChI=1S/C24H25ClFN5O2/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)/b6-5+
InChIKey
LVXJQMNHJWSHET-AATRIKPKSA-N

Alternative Names

  • (2E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-(piperidin-1-yl)but-2-enamide
  • dacomitinib
  • dacomitinibum
  • PF 00299804-03
  • PF-00299804
  • PF-00299804-03

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
2058849
oboInOwl#hasDbXref
Wikipedia:Dacomitinib
core#notation
CHEBI:132268

Additional References

Wikipedia:Dacomitinib

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Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
2058849
oboInOwl#hasDbXref
Wikipedia:Dacomitinib
oboInOwl#id
CHEBI:132268
core#notation
CHEBI:132268
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_74440
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http://purl.obolibrary.org/obo/chebi#3_STAR
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
has_treatment
http://purl.obolibrary.org/obo/DOID_1324
rdf-schema#domain
https://w3id.org/def/predibionto#has_side_effect1835
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t96793
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t3326909