Allitinib | B3002

Allitinib is a novel anilino-quinazoline compound that inhibits ErbB tyrosine kinases: epidermal growth factor receptor (EGFR) and ErbB2. It inhibits EGFR and ErbB2 with IC₅₀ values of 0.5 nM and 3 nM in cell-free assays. It inhibits the phosphorylation of EGFR and ErbB2 and downstream signaling in human cancer cells. It potently inhibits cell lines expressing high levels of ErbB2 such as Calu-3 lung adenocarcinoma and BT474 breast cancer cells with IC₅₀ values of 0.23 μM and 0.97 μM respectively. It inhibits tumor growth in the SK-OV-3 xenograft model.

Allitinib is a novel anilino-quinazoline compound that inhibits ErbB tyrosine kinases: epidermal growth factor receptor (EGFR) and ErbB2. It inhibits EGFR and ErbB2 with IC₅₀ values of 0.5 nM and 3 nM in cell-free assays. It inhibits the phosphorylation of EGFR and ErbB2 and downstream signaling in human cancer cells. It potently inhibits cell lines expressing high levels of ErbB2 such as Calu-3 lung adenocarcinoma and BT474 breast cancer cells with IC₅₀ values of 0.23 μM and 0.97 μM respectively. It inhibits tumor growth in the SK-OV-3 xenograft model.

B3002 | Allitinib DataSheet

Alternate Name/Synonyms: AST-1306; N-(4-(3-Chloro-4-(3-fluorobenzyloxy)phenylamino)quinazolin-6-yl)acrylamide; N-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]quinazolin-6-yl]prop-2-enamide

Appearance: Solid

Formulation:

CAS Number: 897383-62-9

Structure Available?: TRUE

Peptide sequence:

Salt Form: FALSE

Molecular Formula: C₂₄H₁₈ClFN₄O₂

Molecular Weight: 448.9

Cell-Permeable?: TRUE

Purity: >98%

Solubilities: ~20 mg/ml in DMSO

Handling: Do not take internally. Wear gloves and mask when handling the product! Avoid contact by all modes of exposure.

Country of Origin: USA

Tag Line: An irreversible ErbB2 and EGFR inhibitor

MDL Number: MFCD17169993

PubChem CID: 24739943

SMILES: C=CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)Cl

InChi: InChI=1S/C24H18ClFN4O2/c1-2-23(31)29-17-6-8-21-19(11-17)24(28-14-27-21)30-18-7-9-22(20(25)12-18)32-13-15-4-3-5-16(26)10-15/h2-12,14H,1,13H2,(H,29,31)(H,27,28,30)

InChi Key: MVZGYPSXNDCANY-UHFFFAOYSA-N