chempirical

4-Benzoyl-4′-methyldiphenyl sulfide

C20H16OSCAS 83846-85-9304.41 g/mol

Open in Covalent MOL file
SO
KetoneSulfide

Properties

Molecular formula
C20H16OS
Molar mass
304.41 g/mol
Exact mass
304.0922 Da
logP
5.38Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

Identifiers

CAS number
83846-85-9
SMILES
Cc1ccc(Sc2ccc(C(=O)c3ccccc3)cc2)cc1
InChIKey
DBHQYYNDKZDVTN-UHFFFAOYSA-N
InChI
InChI=1S/C20H16OS/c1-15-7-11-18(12-8-15)22-19-13-9-17(10-14-19)20(21)16-5-3-2-4-6-16/h2-14H,1H3

Weigh it out

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

Names and synonyms

16 names · show all
  • Methanone, [4-[(4-methylphenyl)thio]phenyl]phenyl-
  • [4-[(4-Methylphenyl)thio]phenyl]phenylmethanone
  • Quantacure BMS
  • Kayacure BMS
  • Phenyl (p-tolylthio)phenyl ketone
  • 4-(4-Methylphenylthio)benzophenone
  • 4-(p-Tolylthio)benzophenone
  • 4-(4-Tolylthio)benzophenone
  • 4-Benzoyl-4′-methyldiphenyl thioether
  • Speedcure BMS
  • SB-PI 705
  • Runtecure 1030
  • Lunacure BMS
  • BMS
  • Chemcure BMS
  • [4-(4-Methylphenyl)sulfanylphenyl]-phenylmethanone

Work with 4-Benzoyl-4′-methyldiphenyl sulfide

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-Methylbenzophenone134-84-979 % similar 4,4′-Dimethylbenzophenone611-97-264 % similar 3,4'-Dimethylbenzophenone13152-94-864 % similar Esacure 1001M272460-97-662 % similar 3-Methylbenzophenone643-65-258 % similar 1,4-Dibenzoylbenzene3016-97-557 % similar 1-[4-(Phenylthio)phenyl]ethanone10169-55-851 % similar 2,4-Dimethylbenzophenone1140-14-350 % similar

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

Elsewhere

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