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381220-66-2 | N-(8,9-DIMETHOXY-1,3,4,6,11,11A-HEXAHYDRO-2H-BENZO[B]QUINOLIZIN-2-YL)-BENZOFURAN-2-CARBOXAMIDE
CAS No: 381220-66-2 Catalog No: AG00CA8K MDL No:
Product Description
Catalog Number:
AG00CA8K
Chemical Name:
N-(8,9-DIMETHOXY-1,3,4,6,11,11A-HEXAHYDRO-2H-BENZO[B]QUINOLIZIN-2-YL)-BENZOFURAN-2-CARBOXAMIDE
CAS Number:
381220-66-2
Molecular Formula:
C24H26N2O4
Molecular Weight:
406.4742
IUPAC Name:
N-(8,9-dimethoxy-2,3,4,6,11,11a-hexahydro-1H-benzo[b]quinolizin-2-yl)-1-benzofuran-2-carboxamide
InChI:
InChI=1S/C24H26N2O4/c1-28-21-11-16-9-19-13-18(7-8-26(19)14-17(16)12-22(21)29-2)25-24(27)23-10-15-5-3-4-6-20(15)30-23/h3-6,10-12,18-19H,7-9,13-14H2,1-2H3,(H,25,27)
InChI Key:
QTZLEYMNJDXQRD-UHFFFAOYSA-N
SMILES:
COc1cc2CC3CC(CCN3Cc2cc1OC)NC(=O)c1cc2c(o1)cccc2
Properties
Complexity:
616
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
406.189g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
406.482g/mol
Monoisotopic Mass:
406.189g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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