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Chemical structure of Dacomitinib hydrate

GC72889

Dacomitinib hydrate

Also known as (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide;hydrate

Dacomitinib (PF-00299804) drate is an orally active, irreversible pan-ErbB inhibitor

ChemicalCAS1042385-75-0MW487.95FormulaC24H27ClFN5O3
CAS number
1042385-75-0
Molecular weight
487.95
Formula
C24H27ClFN5O3
Solubility
DMSO ： ≥ 48·33 mg/mL (99·05 mM)
InChIKey
BSPLGGCPNTZPIH-IPZCTEOASA-N
Catalogue number
GC72889
Brand
GLPBIO
Computed properties PubChem CID 70693519 · TPSA 80.4 Ų · H-bond donors 3 · H-bond acceptors 8
TPSA
80.4 Ų
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
34

SMILES COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)/C=C/CN4CCCCC4.O

Computed descriptors from PubChem (CID 70693519), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.