diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane

C23H28SSi2 — CID 15262887

IUPACdiphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane
SMILESC[Si](C)(C)C[Si](CSc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H28SSi2/c1-25(2,3)20-26(22-15-9-5-10-16-22,23-17-11-6-12-18-23)19-24-21-13-7-4-8-14-21/h4-18H,19-20H2,1-3H3
InChIKeyUTFFBUGCBZPQAW-UHFFFAOYSA-N
MW392.72 g/mol
LogP5.46
Rot. Bonds7

About diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane

diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane (PubChem CID 15262887) has the molecular formula C23H28SSi2 and a molecular weight of 392.72 g/mol. Its IUPAC name is diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane.

Molecular Properties

Compound Namediphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane
PubChem CID15262887
Molecular FormulaC23H28SSi2
Molecular Weight392.72 g/mol
Exact Mass392.15
IUPAC Namediphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane
SMILESC[Si](C)(C)C[Si](CSc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H28SSi2/c1-25(2,3)20-26(22-15-9-5-10-16-22,23-17-11-6-12-18-23)19-24-21-13-7-4-8-14-21/h4-18H,19-20H2,1-3H3
InChIKeyUTFFBUGCBZPQAW-UHFFFAOYSA-N
XLogP5.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.72
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane?
The IUPAC name of diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane (CID 15262887) is diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane.
What is the SMILES notation for diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane?
The canonical SMILES for diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane is C[Si](C)(C)C[Si](CSc1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane?
The InChIKey is UTFFBUGCBZPQAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28SSi2/c1-25(2,3)20-26(22-15-9-5-10-16-22,23-17-11-6-12-18-23)19-24-21-13-7-4-8-14-21/h4-18H,19-20H2,1-3H3.
What are the key properties of diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane?
diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane has a molecular weight of 392.72 g/mol, XLogP of 5.46, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(phenylsulfanylmethyl)-(trimethylsilylmethyl)silane is sourced from PubChem (CID 15262887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).