Name: O-Desmethyl Astemizole-[d5]
Brand: BOC Sciences
Rating: 5 (1 reviews)

General Information

Catalog: BLP-014989

Molecular Formula: C27H24D5FN4O

Molecular Weight: 449.58

Chemical Structure

Description	O-Desmethyl Astemizole-[d5] is the labelled impurity of Astemizole, which is a nonsedating-type histamine H1-receptor antagonist. Potential for combination therapy with anticancer drugs such as doxorubicin in resistant leukemia. Antihistaminic.
Synonyms	4-(2-(4-((1-(4-Fluorobenzyl)-1H-benzo[d]imidazol-2-yl)amino)piperidin-1-yl-3,3,4,5,5-d5)ethyl)phenol; O-Desmethyl Astemizole-d5; 4-[2-[4-[[1-[(4-Fluorophenyl)methyl]-1H-benzimidazol-2-yl]amino]-1-piperidinyl-d5]ethyl]phenol; Desmethylastemizole-d5; O-Demethylastemizole-d5; R 44271-d5
IUPAC Name	4-[2-[3,3,4,5,5-pentadeuterio-4-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]phenol
Related CAS	73736-50-2 (unlabelled)
Canonical SMILES	[2H]C1(CN(CC(C1([2H])NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)([2H])[2H])CCC5=CC=C(C=C5)O)[2H]
InChI	InChI=1S/C27H29FN4O/c28-22-9-5-21(6-10-22)19-32-26-4-2-1-3-25(26)30-27(32)29-23-14-17-31(18-15-23)16-13-20-7-11-24(33)12-8-20/h1-12,23,33H,13-19H2,(H,29,30)/i14D2,15D2,23D
InChI Key	LAGYWHSFHIMTPE-ZHRCPOFNSA-N
Purity	>95%
Storage	Store at 2-8 °C