About trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane
trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane (PubChem CID 134933158) has the molecular formula C17H20SSeSi
and a molecular weight of 363.46 g/mol. Its IUPAC name is trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane.
Molecular Properties
| Compound Name | trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane |
| PubChem CID | 134933158 |
| Molecular Formula | C17H20SSeSi |
| Molecular Weight | 363.46 g/mol |
| Exact Mass | 364.02 |
| IUPAC Name | trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane |
| SMILES | C[Si](C)(C)/C=C(\Sc1ccccc1)[Se]c1ccccc1 |
| InChI | InChI=1S/C17H20SSeSi/c1-20(2,3)14-17(18-15-10-6-4-7-11-15)19-16-12-8-5-9-13-16/h4-14H,1-3H3/b17-14+ |
| InChIKey | MLALMGNXRYEDBD-SAPNQHFASA-N |
| XLogP | 4.53 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 363.46 |
| LogP ≤ 5 | 4.53 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane 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 trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane?
The IUPAC name of trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane (CID 134933158) is trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane.
What is the SMILES notation for trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane?
The canonical SMILES for trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane is C[Si](C)(C)/C=C(\Sc1ccccc1)[Se]c1ccccc1.
What is the InChIKey of trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane?
The InChIKey is MLALMGNXRYEDBD-SAPNQHFASA-N. The full InChI is InChI=1S/C17H20SSeSi/c1-20(2,3)14-17(18-15-10-6-4-7-11-15)19-16-12-8-5-9-13-16/h4-14H,1-3H3/b17-14+.
What are the key properties of trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane?
trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane has a molecular weight of 363.46 g/mol, XLogP of 4.53, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-2-phenylselanyl-2-phenylsulfanylethenyl]silane is sourced from PubChem (CID 134933158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).