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89459-42-7 | 4-Acridinecarboxamide, N-[2-(dimethylamino)ethyl]-9-(methylamino)-
CAS No: 89459-42-7 Catalog No: AG004431 MDL No:
Product Description
Catalog Number:
AG004431
Chemical Name:
4-Acridinecarboxamide, N-[2-(dimethylamino)ethyl]-9-(methylamino)-
CAS Number:
89459-42-7
Molecular Formula:
C19H22N4O
Molecular Weight:
322.4042
IUPAC Name:
N-[2-(dimethylamino)ethyl]-9-(methylamino)acridine-4-carboxamide
InChI:
InChI=1S/C19H22N4O/c1-20-17-13-7-4-5-10-16(13)22-18-14(17)8-6-9-15(18)19(24)21-11-12-23(2)3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,24)
InChI Key:
CBVKULYLFMNGTC-UHFFFAOYSA-N
SMILES:
CNc1c2cccc(c2nc2c1cccc2)C(=O)NCCN(C)C
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.179g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
322.412g/mol
Monoisotopic Mass:
322.179g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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