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89502-82-9 | Acetamide, N-[5-(dihexylamino)-2-[(5-nitro-2-thiazolyl)azo]phenyl]-
CAS No: 89502-82-9 Catalog No: AG0041OG MDL No:
Product Description
Catalog Number:
AG0041OG
Chemical Name:
Acetamide, N-[5-(dihexylamino)-2-[(5-nitro-2-thiazolyl)azo]phenyl]-
CAS Number:
89502-82-9
Molecular Formula:
C23H34N6O3S
Molecular Weight:
474.6195
IUPAC Name:
N-[5-(dihexylamino)-2-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl]acetamide
InChI:
InChI=1S/C23H34N6O3S/c1-4-6-8-10-14-28(15-11-9-7-5-2)19-12-13-20(21(16-19)25-18(3)30)26-27-23-24-17-22(33-23)29(31)32/h12-13,16-17H,4-11,14-15H2,1-3H3,(H,25,30)
InChI Key:
JEIVPDLYXVQTBG-UHFFFAOYSA-N
SMILES:
CCCCCCN(c1ccc(c(c1)NC(=O)C)N=Nc1ncc(s1)[N+](=O)[O-])CCCCCC
Properties
Complexity:
606
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
474.241g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
474.624g/mol
Monoisotopic Mass:
474.241g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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