Ivabradine-d3 Hydrochloride

Analyte Name

Ivabradine hydrochloride N-methyl-d3

CAS Number

1217809-61-4

Molecular Formula

C27 2H3 H33 N2 O5 . Cl H

Molecular Weight

508.06

Accurate Mass

507.2579

SMILES

Cl.[2H]C([2H])([2H])N(CCCN1CCc2cc(OC)c(OC)cc2CC1=O)C[C@H]3Cc4cc(OC)c(OC)cc34

InChI

InChI=1S/C27H36N2O5.ClH/c1-28(17-21-11-20-14-25(33-4)26(34-5)16-22(20)21)8-6-9-29-10-7-18-12-23(31-2)24(32-3)13-19(18)15-27(29)30;/h12-14,16,21H,6-11,15,17H2,1-5H3;1H/t21-;/m1./s1/i1D3;

IUPAC

3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-(trideuteriomethyl)amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one;hydrochloride

Unlabelled CAS Number

148849-67-6

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Ivabradine