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85990-00-7 | 9(10H)-Acridinone, 1,3,5-trihydroxy-
CAS No: 85990-00-7 Catalog No: AG004Q2T MDL No:
Product Description
Catalog Number:
AG004Q2T
Chemical Name:
9(10H)-Acridinone, 1,3,5-trihydroxy-
CAS Number:
85990-00-7
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
IUPAC Name:
1,3,5-trihydroxy-10H-acridin-9-one
InChI:
InChI=1S/C13H9NO4/c15-6-4-8-11(10(17)5-6)13(18)7-2-1-3-9(16)12(7)14-8/h1-5,15-17H,(H,14,18)
InChI Key:
QCNWCELEAMCXOV-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c2c(c1)[nH]c1c(c2=O)cccc1O
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.053g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
243.218g/mol
Monoisotopic Mass:
243.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Structure-activity relationship studies of acridones as potential antipsoriatic agents. 1. Synthesis and antiproliferative activity of simple N-unsubstituted 10H-acridin-9-ones against human keratinocyte growth. | European journal of medicinal chemistry 20100801 |
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