200,000+ products from a single source!
sales@angenechem.com
67950-89-4 | 5,7-DIHYDROXY-1-(3,4,5-TRIMETHOXYBENZYL)-1,2,3,4-TETRAHYDROISOQUINOLINE
CAS No: 67950-89-4 Catalog No: AG005OPC MDL No:
Product Description
Catalog Number:
AG005OPC
Chemical Name:
5,7-DIHYDROXY-1-(3,4,5-TRIMETHOXYBENZYL)-1,2,3,4-TETRAHYDROISOQUINOLINE
CAS Number:
67950-89-4
Molecular Formula:
C19H23NO5
Molecular Weight:
345.3896
IUPAC Name:
1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-5,7-diol
InChI:
InChI=1S/C19H23NO5/c1-23-17-7-11(8-18(24-2)19(17)25-3)6-15-14-9-12(21)10-16(22)13(14)4-5-20-15/h7-10,15,20-22H,4-6H2,1-3H3
InChI Key:
JOUMAXMNBTXGQC-UHFFFAOYSA-N
SMILES:
COc1c(OC)cc(cc1OC)CC1NCCc2c1cc(O)cc2O
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
345.395g/mol
Monoisotopic Mass:
345.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.