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Ebastine-[d5]

General Information
Catalog: BLP-012332
CAS: 1216953-13-7
Molecular Formula: C32H34D5NO2
Molecular Weight: 474.68
Chemical Structure
Ebastine-[d5]
Description Ebastine-[d5] is the labelled analogue of Ebastine, which is a potent second generation histamine H1 receptor antagonist.
Synonyms Ebastine D5
IUPAC Name 1-(4-tert-butylphenyl)-4-[4-[(2,3,4,5,6-pentadeuteriophenyl)-phenylmethoxy]piperidin-1-yl]butan-1-one
Related CAS 90729-43-4 (unlabelled)
Canonical SMILES CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4
InChI InChI=1S/C32H39NO2/c1-32(2,3)28-18-16-25(17-19-28)30(34)15-10-22-33-23-20-29(21-24-33)35-31(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-9,11-14,16-19,29,31H,10,15,20-24H2,1-3H3/i4D,6D,7D,11D,12D
InChI Key MJJALKDDGIKVBE-UAVBZTRNSA-N
Melting Point 70-72°C
Purity 95% by HPLC; 95% atom D
Solubility Soluble in Methanol
Appearance Yellow Solid
Storage Store at -20°C

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