Name: N-Desmethyl Ivabradine-[d6] Hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

General Information

Catalog: BLP-012883

CAS: 1346600-74-5

Molecular Formula: C26H29D6ClN2O5

Molecular Weight: 497.02

Chemical Structure

Description	N-Desmethyl Ivabradine-[d6] Hydrochloride is the labelled analogue of N-Desmethyl Ivabradine Hydrochloride, which is a metabolite of Ivabradine. Ivabradine can be used to treat chronic stable angina pectoris in patients with normal sinus rhythm.
Synonyms	N-Desmethyl Ivabradine D6 Hydrochloride; 3-[3-[[[(7S)-3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]amino]propyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-3-benzazepin-2-one-d6 Hydrochloride; N-Demethylivabradine-d6 Hydrochloride
IUPAC Name	3-[1,1,2,2,3,3-hexadeuterio-3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one;hydrochloride
Related CAS	1246638-08-3 (unlabelled) 215935-23-2 (unlabelled free base)
Canonical SMILES	COC1=C(C=C2CC(=O)N(CCC2=C1)CCCNCC3CC4=CC(=C(C=C34)OC)OC)OC.Cl
InChI	InChI=1S/C26H34N2O5.ClH/c1-30-22-11-17-6-9-28(26(29)14-18(17)12-23(22)31-2)8-5-7-27-16-20-10-19-13-24(32-3)25(33-4)15-21(19)20;/h11-13,15,20,27H,5-10,14,16H2,1-4H3;1H/t20-;/m1./s1/i5D2,7D2,8D2;
InChI Key	MIIIKWNQFDQJGS-OTVKAUOOSA-N
Purity	98% by HPLC
Solubility	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance	White to Beige Solid
Storage	Store at 2-8°C