3-tris(sulfanyl)silylpropane-1-thiol

C3H10S4Si — CID 88846619

IUPAC3-tris(sulfanyl)silylpropane-1-thiol
SMILESSCCC[Si](S)(S)S
InChIInChI=1S/C3H10S4Si/c4-2-1-3-8(5,6)7/h4-7H,1-3H2
InChIKeyKJNXOZIQBSBFAY-UHFFFAOYSA-N
MW202.47 g/mol
LogP2.03
Rot. Bonds3

About 3-tris(sulfanyl)silylpropane-1-thiol

3-tris(sulfanyl)silylpropane-1-thiol (PubChem CID 88846619) has the molecular formula C3H10S4Si and a molecular weight of 202.47 g/mol. Its IUPAC name is 3-tris(sulfanyl)silylpropane-1-thiol.

Molecular Properties

Compound Name3-tris(sulfanyl)silylpropane-1-thiol
PubChem CID88846619
Molecular FormulaC3H10S4Si
Molecular Weight202.47 g/mol
Exact Mass201.94
IUPAC Name3-tris(sulfanyl)silylpropane-1-thiol
SMILESSCCC[Si](S)(S)S
InChIInChI=1S/C3H10S4Si/c4-2-1-3-8(5,6)7/h4-7H,1-3H2
InChIKeyKJNXOZIQBSBFAY-UHFFFAOYSA-N
XLogP2.03
TPSA0.00 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.47
LogP ≤ 52.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Analyze 3-tris(sulfanyl)silylpropane-1-thiol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-tris(sulfanyl)silylpropane-1-thiol?
The IUPAC name of 3-tris(sulfanyl)silylpropane-1-thiol (CID 88846619) is 3-tris(sulfanyl)silylpropane-1-thiol.
What is the SMILES notation for 3-tris(sulfanyl)silylpropane-1-thiol?
The canonical SMILES for 3-tris(sulfanyl)silylpropane-1-thiol is SCCC[Si](S)(S)S.
What is the InChIKey of 3-tris(sulfanyl)silylpropane-1-thiol?
The InChIKey is KJNXOZIQBSBFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10S4Si/c4-2-1-3-8(5,6)7/h4-7H,1-3H2.
What are the key properties of 3-tris(sulfanyl)silylpropane-1-thiol?
3-tris(sulfanyl)silylpropane-1-thiol has a molecular weight of 202.47 g/mol, XLogP of 2.03, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tris(sulfanyl)silylpropane-1-thiol is sourced from PubChem (CID 88846619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).