Free Chemical Databases
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[Synonyms]
NSC145189
NSC 145189
27221-40-5
[Structure]
[ Properties Computed from Structure]
Molecular Weight 255.26862 [g/mol] Molecular Formula C15H13NO3 XLogP 2.6 H-Bond Donor 1 H-Bond Acceptor 4 Rotatable Bond Count 2 Tautomer Count 3 Exact Mass 255.089543 MonoIsotopic Mass 255.089543 Topological Polar Surface Area 47.6 Heavy Atom Count 19 Formal Charge 0 Complexity 346 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 1,3-dimethoxy-10H-acridin-9-one
Canonical SMILES: COC1=CC(=C2C(=C1)NC3=CC=CC=C3C2=O)OC
InChI: InChI=1/C15H13NO3/c1-18-9-7-12-14(13(8-9)19-2)15(17)10-5-3-4-6-11(10)16-
12/h3-8H,1-2H3,(H,16,17)/f/h16H
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