diphenyl-(4-phenylsulfanylphenyl)sulfanium

C24H19S2+ — CID 3296071

IUPACdiphenyl-(4-phenylsulfanylphenyl)sulfanium
SMILESc1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C24H19S2/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-19H/q+1
InChIKeyOWZDULOODZHVCQ-UHFFFAOYSA-N
MW371.55 g/mol
LogP6.93
Rot. Bonds5

About diphenyl-(4-phenylsulfanylphenyl)sulfanium

diphenyl-(4-phenylsulfanylphenyl)sulfanium (PubChem CID 3296071) has the molecular formula C24H19S2+ and a molecular weight of 371.55 g/mol. Its IUPAC name is diphenyl-(4-phenylsulfanylphenyl)sulfanium.

Molecular Properties

Compound Namediphenyl-(4-phenylsulfanylphenyl)sulfanium
PubChem CID3296071
Molecular FormulaC24H19S2+
Molecular Weight371.55 g/mol
Exact Mass371.09
IUPAC Namediphenyl-(4-phenylsulfanylphenyl)sulfanium
SMILESc1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C24H19S2/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-19H/q+1
InChIKeyOWZDULOODZHVCQ-UHFFFAOYSA-N
XLogP6.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.55
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

Analyze diphenyl-(4-phenylsulfanylphenyl)sulfanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Lead, triphenyl(phenylthio)-
CID 16682797
4,4'-Thiobisbenzenethiol
CID 619483
Phosphine, tris(p-methylthiophenyl)-
CID 207408
Tris(phenylthio)methane
CID 615706
Triphenylsulfonium chloride
CID 61343
Sulfonium, triphenyl-, (OC-6-11)-hexafluoroantimonate(1-) (1:1)
CID 93820
Sulfonium, triphenyl-, hexafluoroarsenate(1-) (1:1)
CID 93839
Sulfonium, diphenyl[4-(phenylthio)phenyl]-, (OC-6-11)-hexafluoroantimonate(1-) (1:1)
CID 16688304
1-Propene, 3,3,3-Trifluoro-1,1,2-tris(phenylthio)-
CID 616198
((2-(Phenylthio)-1-cyclobuten-1-yl)thio)benzene
CID 332690
Phosphine, tris(2-(methylthio)phenyl)-
CID 398155
Benzene, 1,2-bis(phenylthio)-
CID 76910

Frequently Asked Questions

What is the IUPAC name of diphenyl-(4-phenylsulfanylphenyl)sulfanium?
The IUPAC name of diphenyl-(4-phenylsulfanylphenyl)sulfanium (CID 3296071) is diphenyl-(4-phenylsulfanylphenyl)sulfanium.
What is the SMILES notation for diphenyl-(4-phenylsulfanylphenyl)sulfanium?
The canonical SMILES for diphenyl-(4-phenylsulfanylphenyl)sulfanium is c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of diphenyl-(4-phenylsulfanylphenyl)sulfanium?
The InChIKey is OWZDULOODZHVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19S2/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-19H/q+1.
What are the key properties of diphenyl-(4-phenylsulfanylphenyl)sulfanium?
diphenyl-(4-phenylsulfanylphenyl)sulfanium has a molecular weight of 371.55 g/mol, XLogP of 6.93, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(4-phenylsulfanylphenyl)sulfanium is sourced from PubChem (CID 3296071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).