200,000+ products from a single source!
sales@angenechem.com
88524-57-6 | (1r)-1-[3-(4-{[(1r)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)-4-hydroxybenzyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol
CAS No: 88524-57-6 Catalog No: AG00481S MDL No:
Product Description
Catalog Number:
AG00481S
Chemical Name:
(1r)-1-[3-(4-{[(1r)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)-4-hydroxybenzyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol
CAS Number:
88524-57-6
Molecular Formula:
C35H38N2O6
Molecular Weight:
582.6860
IUPAC Name:
(1R)-1-[[3-[4-[[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol
InChI:
InChI=1S/C35H38N2O6/c1-40-32-17-23-10-12-37-29(26(23)19-31(32)39)15-22-6-9-30(38)33(16-22)43-25-7-4-21(5-8-25)14-28-27-20-35(42-3)34(41-2)18-24(27)11-13-36-28/h4-9,16-20,28-29,36-39H,10-15H2,1-3H3/t28-,29-/m1/s1
InChI Key:
GNMKIHRRWFMRDN-FQLXRVMXSA-N
SMILES:
COc1cc2[C@H](NCCc2cc1OC)Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]1NCCc2c1cc(O)c(c2)OC
Properties
Complexity:
856
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
582.273g/mol
Formal Charge:
0
Heavy Atom Count:
43
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
582.697g/mol
Monoisotopic Mass:
582.273g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.