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Anagrelide-[13C3]

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General Information
Catalog: BLP-011785
CAS: 1219531-58-4
Molecular Formula: C7[13C]3H7Cl2N3O
Molecular Weight: 259.06

Chemical Structure

Description	Anagrelide-[13C3] is the labelled analogue of Anagrelide, which is a phosphodiesterase inhibitor with antiplatelet activity. It is a medication used for the treatment of essential thrombocytosis (ET).
Synonyms	Anagrelide 13C3; 6,7-Dichloro-1,5-dihydroimidazo[2,1-b]quinazolin-2(3H)-one-13C3; BL-4162A-13C3; BMY-26538-01-13C3; Agrylin-13C3; Tromboreductin-13C3; Xagrid-13C3
IUPAC Name	6,7-dichloro-3,5-dihydro-1H-(2,4,5-13C3)imidazolo[2,1-b]quinazolin-2-one
Related CAS	68475-42-3 (unlabelled)
Canonical SMILES	C1C2=C(C=CC(=C2Cl)Cl)N=C3N1CC(=O)N3
InChI	InChI=1S/C10H7Cl2N3O/c11-6-1-2-7-5(9(6)12)3-15-4-8(16)14-10(15)13-7/h1-2H,3-4H2,(H,13,14,16)/i4+1,8+1,10+1
InChI Key	OTBXOEAOVRKTNQ-PTCNTQLJSA-N
Melting Point	>300°C (dec.)
Purity	98%; ≥99% atom 13C
Solubility	Soluble in TFA (Slightly)
Appearance	Off-white to Pale Yellow Solid
Storage	Store at -20°C