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100113-03-9 | 4-Acridinecarboxamide, 9-amino-N-[2-(dimethylamino)ethyl]-2-methyl-, hydrochloride (1:2)
CAS No: 100113-03-9 Catalog No: AG0000ZE MDL No:
Product Description
Catalog Number:
AG0000ZE
Chemical Name:
4-Acridinecarboxamide, 9-amino-N-[2-(dimethylamino)ethyl]-2-methyl-, hydrochloride (1:2)
CAS Number:
100113-03-9
Molecular Formula:
C19H24Cl2N4O
Molecular Weight:
395.3261
IUPAC Name:
9-amino-N-[2-(dimethylamino)ethyl]-2-methylacridine-4-carboxamide;dihydrochloride
InChI:
InChI=1S/C19H22N4O.2ClH/c1-12-10-14-17(20)13-6-4-5-7-16(13)22-18(14)15(11-12)19(24)21-8-9-23(2)3;;/h4-7,10-11H,8-9H2,1-3H3,(H2,20,22)(H,21,24);2*1H
InChI Key:
RWISVLAGEUWSKJ-UHFFFAOYSA-N
SMILES:
CN(CCNC(=O)c1cc(C)cc2c1nc1ccccc1c2N)C.Cl.Cl
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.133g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
395.328g/mol
Monoisotopic Mass:
394.133g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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