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89459-23-4

89459-23-4 | 4-Acridinecarboxamide, 9-chloro-N-[2-(dimethylamino)ethyl]-

CAS No: 89459-23-4 Catalog No: AG0042FK MDL No:

Product Description

Catalog Number:
AG0042FK
Chemical Name:
4-Acridinecarboxamide, 9-chloro-N-[2-(dimethylamino)ethyl]-
CAS Number:
89459-23-4
Molecular Formula:
C18H18ClN3O
Molecular Weight:
327.8080
IUPAC Name:
9-chloro-N-[2-(dimethylamino)ethyl]acridine-4-carboxamide
InChI:
InChI=1S/C18H18ClN3O/c1-22(2)11-10-20-18(23)14-8-5-7-13-16(19)12-6-3-4-9-15(12)21-17(13)14/h3-9H,10-11H2,1-2H3,(H,20,23)
InChI Key:
FWRXXQLUCNPCOM-UHFFFAOYSA-N
SMILES:
CN(CCNC(=O)c1cccc2c1nc1ccccc1c2Cl)C

Properties

Complexity:
417  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.114g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
327.812g/mol
Monoisotopic Mass:
327.114g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Literature

Title Journal
Bisintercalating threading diacridines: relationships between DNA binding, cytotoxicity, and cell cycle arrest. Journal of medicinal chemistry 20031218

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