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189769-43-5 | Acridinedisulfonamide, N-[2-(dibutylamino)ethyl]-9,10-dihydro-9-oxo- (9CI)
CAS No: 189769-43-5 Catalog No: AG002DY3 MDL No:
Product Description
Catalog Number:
AG002DY3
Chemical Name:
Acridinedisulfonamide, N-[2-(dibutylamino)ethyl]-9,10-dihydro-9-oxo- (9CI)
CAS Number:
189769-43-5
Molecular Formula:
C23H32N4O5S2
Molecular Weight:
508.6540
IUPAC Name:
1-N-[2-(dibutylamino)ethyl]-9-oxo-10H-acridine-1,2-disulfonamide
InChI:
InChI=1S/C23H32N4O5S2/c1-3-5-14-27(15-6-4-2)16-13-25-34(31,32)23-20(33(24,29)30)12-11-19-21(23)22(28)17-9-7-8-10-18(17)26-19/h7-12,25H,3-6,13-16H2,1-2H3,(H,26,28)(H2,24,29,30)
InChI Key:
RXPDVSSEQZADKZ-UHFFFAOYSA-N
SMILES:
CCCCN(CCNS(=O)(=O)c1c2c(ccc1S(=O)(=O)N)[nH]c1c(c2=O)cccc1)CCCC
Properties
Complexity:
876
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
508.181g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
508.652g/mol
Monoisotopic Mass:
508.181g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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