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Bazedoxifene-[d4] Acetate

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General Information
Catalog: BLP-013883
CAS: 1133695-49-4
Molecular Formula: C32H38N2O5
Molecular Weight: 534.7

Chemical Structure

Description	Bazedoxifene-[d4] Acetate is an isotope labelled Bazedoxifene Acetate, which is a nonsteroidal selective estrogen receptor modulator for the treatment of osteoporosis in postmenopausal women.
Synonyms	Bazedoxifene-d4 Acetate; TSE 424-d4; Viviant-d4; WAY-TES 424-d4
IUPAC Name	acetic acid;1-[[4-[2-(azepan-1-yl)-1,1,2,2-tetradeuterioethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol
Related CAS	198481-33-3 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C([2H])([2H])OC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)O)C(=C2C4=CC=C(C=C4)O)C)N5CCCCCC5.CC(=O)O
Canonical SMILES	CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)OCCN4CCCCCC4)C5=CC=C(C=C5)O.CC(=O)O
InChI	InChI=1S/C30H34N2O3.C2H4O2/c1-22-28-20-26(34)12-15-29(28)32(30(22)24-8-10-25(33)11-9-24)21-23-6-13-27(14-7-23)35-19-18-31-16-4-2-3-5-17-31;1-2(3)4/h6-15,20,33-34H,2-5,16-19,21H2,1H3;1H3,(H,3,4)/i18D2,19D2;
InChI Key	OMZAMQFQZMUNTP-ZQAHQZODSA-N
Melting Point	>112°C
Purity	>95%; 98% atom D
Appearance	Gray Solid