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89459-55-2 | 4-Acridinecarboxamide, 6,9-diamino-N-[2-(dimethylamino)ethyl]-
CAS No: 89459-55-2 Catalog No: AG0042JR MDL No:
Product Description
Catalog Number:
AG0042JR
Chemical Name:
4-Acridinecarboxamide, 6,9-diamino-N-[2-(dimethylamino)ethyl]-
CAS Number:
89459-55-2
Molecular Formula:
C18H21N5O
Molecular Weight:
323.3922
IUPAC Name:
6,9-diamino-N-[2-(dimethylamino)ethyl]acridine-4-carboxamide
InChI:
InChI=1S/C18H21N5O/c1-23(2)9-8-21-18(24)14-5-3-4-13-16(20)12-7-6-11(19)10-15(12)22-17(13)14/h3-7,10H,8-9,19H2,1-2H3,(H2,20,22)(H,21,24)
InChI Key:
UZHVEQZSNGCIFP-UHFFFAOYSA-N
SMILES:
CN(CCNC(=O)c1cccc2c1nc1cc(N)ccc1c2N)C
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.175g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
323.4g/mol
Monoisotopic Mass:
323.175g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
97.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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