• 
  [Synonyms]
  AIDS156575
  AIDS-156575
  NCI60_007996
  NSC625628 (HYDROCHLORIDE SALT)
  N~4~-(6-Chloro-2-methoxy-4,5-dimethyl-9-acridinyl)-N~1~,N~1~-diethyl-1,4-pentanediamine hydrochloride
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	428.00996 [g/mol]
  Molecular Formula	C25H34ClN3O
  XLogP	6
  H-Bond Donor	1
  H-Bond Acceptor	4
  Rotatable Bond Count	9
  Tautomer Count	2
  Exact Mass	427.23904
  MonoIsotopic Mass	427.23904
  Topological Polar Surface Area	37.4
  Heavy Atom Count	30
  Formal Charge	0
  Complexity	517
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	1
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	1

  
  [ Descriptors Computed from Structure]
  IUPAC Name: N'-(6-chloro-2-methoxy-4,5-dimethylacridin-9-yl)-N,N-diethylpentane-1,
  4-diamine
  Canonical SMILES: CCN(CC)CCCC(C)NC1=C2C=CC(=C(C2=NC3=C(C=C(C=C31)OC)C)C)Cl
  InChI: InChI=1/C25H34ClN3O/c1-7-29(8-2)13-9-10-17(4)27-25-20-11-12-22(26)18(5)
  24(20)28-23-16(3)14-19(30-6)15-21(23)25/h11-12,14-15,17H,7-10,13H2,
  1-6H3,(H,27,28)/f/h27H