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88741-67-7 | 7H-Dibenzo[de,h]quinolin-7-one,6-hydroxy-5,10-dimethoxy-
CAS No: 88741-67-7 Catalog No: AG004E19 MDL No:
Product Description
Catalog Number:
AG004E19
Chemical Name:
7H-Dibenzo[de,h]quinolin-7-one,6-hydroxy-5,10-dimethoxy-
CAS Number:
88741-67-7
Molecular Formula:
C18H13NO4
Molecular Weight:
307.3001
IUPAC Name:
10-hydroxy-4,11-dimethoxy-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaen-8-one
InChI:
InChI=1S/C18H13NO4/c1-22-10-3-4-11-12(8-10)16-14-9(5-6-19-16)7-13(23-2)18(21)15(14)17(11)20/h3-8,21H,1-2H3
InChI Key:
BKPROUCYAMSITF-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c1nccc3c1c(C2=O)c(O)c(c3)OC
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.084g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.305g/mol
Monoisotopic Mass:
307.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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