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64986-29-4 | 1,2,3,4-Tetrahydro-6-methoxy-2-methyl-1-[2-[4-[[1,2,3,4-tetrahydro-1-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-2-methylisoquinolin-7-yl]oxy]phenyl]ethyl]isoquinolin-7-ol
CAS No: 64986-29-4 Catalog No: AG00F7II MDL No:
Product Description
Catalog Number:
AG00F7II
Chemical Name:
1,2,3,4-Tetrahydro-6-methoxy-2-methyl-1-[2-[4-[[1,2,3,4-tetrahydro-1-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-2-methylisoquinolin-7-yl]oxy]phenyl]ethyl]isoquinolin-7-ol
CAS Number:
64986-29-4
IUPAC Name:
1-[2-[4-[[1-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenyl]ethyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
InChI:
InChI=1S/C38H44N2O5/c1-39-19-17-27-21-36(43-3)35(42)23-31(27)33(39)15-10-26-7-13-30(14-8-26)45-38-24-32-28(22-37(38)44-4)18-20-40(2)34(32)16-9-25-5-11-29(41)12-6-25/h5-8,11-14,21-24,33-34,41-42H,9-10,15-20H2,1-4H3
InChI Key:
KUXKTKLZRVDZSO-UHFFFAOYSA-N
Properties
Complexity:
891
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
608.325g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
608.779g/mol
Monoisotopic Mass:
608.325g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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