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cis-Tadalafil-[d3]

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General Information
Catalog: BLP-002278
CAS: 1329799-70-3
Molecular Formula: C22H16D3N3O4
Molecular Weight: 392.42

Chemical Structure

Description	cis-Tadalafil-[d3], is the labelled analogue of cis-Tadalafil, which is an impurity of Tadalafil. Tadalafil is a medication used to treat erectile dysfunction, benign prostatic hyperplasia, and pulmonary arterial hypertension.
Synonyms	(6R,12aS)-Tadalafil-d3; Tadalafil EP Impurity A-d3; cis-Tadalafil-d3; (2R,8S)-2-(1,3-benzodioxol-5-yl)-6-methyl-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-4,7-dione-d3; (6R,12aS)-6-(1,3-Benzodioxol-5-yl)-2-methyl-2,3,6,7,12,12a-hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indole-1,4-dione-d3
IUPAC Name	(2R,8S)-2-(1,3-benzodioxol-5-yl)-6-(trideuteriomethyl)-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-4,7-dione
Related CAS	171596-27-3 (unlabelled)
Canonical SMILES	CN1CC(=O)N2C(C1=O)CC3=C(C2C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C36
InChI	InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21+/m0/s1/i1D3
InChI Key	WOXKDUGGOYFFRN-MASZXHQHSA-N
Melting Point	282-284°C (dec.)
Purity	98%
Solubility	Soluble in DMSO
Appearance	White Solid
Storage	Store at -20°C