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19845-26-2 | 6H-Dibenzo[a,g]quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-11-methyl-
CAS No: 19845-26-2 Catalog No: AG002BIF MDL No:
Product Description
Catalog Number:
AG002BIF
Chemical Name:
6H-Dibenzo[a,g]quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-11-methyl-
CAS Number:
19845-26-2
Molecular Formula:
C22H27NO4
Molecular Weight:
369.4541
IUPAC Name:
2,3,9,10-tetramethoxy-11-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
InChI:
InChI=1S/C22H27NO4/c1-13-8-15-9-18-16-11-20(25-3)19(24-2)10-14(16)6-7-23(18)12-17(15)22(27-5)21(13)26-4/h8,10-11,18H,6-7,9,12H2,1-5H3
InChI Key:
UFFXXAAMESJFNM-UHFFFAOYSA-N
SMILES:
COc1cc2c(cc1OC)CCN1C2Cc2cc(C)c(c(c2C1)OC)OC
Properties
Complexity:
503
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.194g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.461g/mol
Monoisotopic Mass:
369.194g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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