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Vandetanib-[d4]

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General Information
Catalog: BLP-012648
CAS: 1215100-18-7
Molecular Formula: C22H20D4BrFN4O2
Molecular Weight: 479.38

Chemical Structure

Description	Vandetanib-[d4] is the labelled analogue of Vandetanib. Vandetanib is an antitumor drug used for the treatment of medullary thyroid cancer. Vandetanib effects through inhibiting vascular endothelial growth factor receptor-2 (VEGFR), epidermal growth factor receptor (EGFR) and the RET-tyrosine kinase activity.
Synonyms	Vandetanib D4; N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-[[1-methyl-4-(piperidinyl-d4)]methoxy]-4-quinazolinamin
IUPAC Name	N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(2,2,6,6-tetradeuterio-1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine
Related CAS	443913-73-3 (unlabelled)
Canonical SMILES	CN1CCC(CC1)COC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Br)F)OC
InChI	InChI=1S/C22H24BrFN4O2/c1-28-7-5-14(6-8-28)12-30-21-11-19-16(10-20(21)29-2)22(26-13-25-19)27-18-4-3-15(23)9-17(18)24/h3-4,9-11,13-14H,5-8,12H2,1-2H3,(H,25,26,27)/i7D2,8D2
InChI Key	UHTHHESEBZOYNR-OSEHSPPNSA-N
Boiling Point	538.2±50.0 °C at 760 mmHg
Purity	95% by HPLC; 98% atom D
Density	1.4±0.1 g/cm3