chempirical

4,4′-[Sulfonylbis(4,1-phenyleneoxy)]bis[benzenamine]

C24H20N2O4SCAS 13080-89-2432.49 g/mol

Open in Covalent MOL file
H2NOSOOOH2N
EtherPrimary amineSulfone

Properties

Molecular formula
C24H20N2O4S
Molar mass
432.49 g/mol
Exact mass
432.1144 Da
Melting point
188–191 °C
logP
5.27Crippen estimate
Polar surface area
104.6 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
6

Identifiers

CAS number
13080-89-2
SMILES
Nc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(N)cc4)cc3)cc2)cc1
InChIKey
UTDAGHZGKXPRQI-UHFFFAOYSA-N
InChI
InChI=1S/C24H20N2O4S/c25-17-1-5-19(6-2-17)29-21-9-13-23(14-10-21)31(27,28)24-15-11-22(12-16-24)30-20-7-3-18(26)4-8-20/h1-16H,25-26H2

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Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Benzenamine, 4,4′-[sulfonylbis(4,1-phenyleneoxy)]bis-
  • Aniline, 4,4′-[sulfonylbis(p-phenyleneoxy)]di-
  • Bis[4-(4-aminophenoxy)phenyl] sulfone
  • Bis[p-(p-aminophenoxy)phenyl] sulfone
  • 4,4′-[Sulfonylbis(p-phenyleneoxy)]dianiline
  • 4,4′-Bis(4-aminophenoxy)diphenyl sulfone
  • SED
  • Bis[4-(4′-aminophenoxy)phenyl) sulfone
  • 4,4′-(Sulfonylbis(4,1-phenylene))bis(oxy)dianiline

Work with 4,4′-[Sulfonylbis(4,1-phenyleneoxy)]bis[benzenamine]

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,4'-Oxydianiline101-80-463 % similar 4,4′-[1,4-Phenylenebis(oxy)]bis[benzenamine]3491-12-163 % similar 1,3,5-Tris(4-aminophenoxy)benzene (135tapob)102852-92-656 % similar 4,4'-Bis(4-aminophenoxy)biphenyl13080-85-856 % similar (4-Aminophenoxy)benzene139-59-354 % similar 4-(4-Chlorophenoxy)benzenamine101-79-150 % similar 1,3-Bis(4-aminophenoxy)benzene2479-46-150 % similar 4-(4-Methylphenoxy)benzenamine41295-20-950 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3,3′-[Sulfonylbis(4,1-phenyleneoxy)]bis[benzenamine]30203-11-3

Elsewhere

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