200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1217809-61-4
1217809-61-4 | Ivabradine-d3 Hydrochloride
CAS No: 1217809-61-4 Catalog No: AG0015YW MDL No:MFCD21363645
Product Description
Catalog Number:
AG0015YW
Chemical Name:
Ivabradine-d3 Hydrochloride
CAS Number:
1217809-61-4
Molecular Formula:
C27H34ClD3N2O5
Molecular Weight:
508.0646
MDL Number:
MFCD21363645
IUPAC Name:
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
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;
InChI Key:
HLUKNZUABFFNQS-AFMQDYKRSA-N
SMILES:
COc1cc2C[C@@H](c2cc1OC)CN(C([2H])([2H])[2H])CCCN1CCc2c(CC1=O)cc(c(c2)OC)OC.Cl
Properties
Complexity:
663
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
507.258g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
3
Molecular Weight:
508.07g/mol
Monoisotopic Mass:
507.258g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.