trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane

C20H27NO2SSi2 — CID 12733310

IUPACtrimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane
SMILESC[Si](C)(C)c1ccccc1S(=O)(=O)n1c([Si](C)(C)C)cc2ccccc21
InChIInChI=1S/C20H27NO2SSi2/c1-25(2,3)19-14-10-9-13-18(19)24(22,23)21-17-12-8-7-11-16(17)15-20(21)26(4,5)6/h7-15H,1-6H3
InChIKeyWQDVWBMMJMDALJ-UHFFFAOYSA-N
MW401.68 g/mol
LogP3.97
Rot. Bonds4

About trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane

trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane (PubChem CID 12733310) has the molecular formula C20H27NO2SSi2 and a molecular weight of 401.68 g/mol. Its IUPAC name is trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane
PubChem CID12733310
Molecular FormulaC20H27NO2SSi2
Molecular Weight401.68 g/mol
Exact Mass401.13
IUPAC Nametrimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane
SMILESC[Si](C)(C)c1ccccc1S(=O)(=O)n1c([Si](C)(C)C)cc2ccccc21
InChIInChI=1S/C20H27NO2SSi2/c1-25(2,3)19-14-10-9-13-18(19)24(22,23)21-17-12-8-7-11-16(17)15-20(21)26(4,5)6/h7-15H,1-6H3
InChIKeyWQDVWBMMJMDALJ-UHFFFAOYSA-N
XLogP3.97
TPSA39.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.68
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-trimethylsilyl-1-(2-trimethylsilylphenyl)sulfonylindol-3-yl] trifluoromethanesulfonate
CID 10437533
[1-(benzenesulfonyl)indol-2-yl]-trimethylstannane
CID 15421387
trimethyl-(1-methylindol-2-yl)silane;trimethyl-(1-methylindol-3-yl)silane
CID 158346898
ethane;trimethyl-(1-propylindol-2-yl)silane
CID 91266795
CID 88588324
CID 88588324
trimethyl-(3-trimethylsilylnaphthalen-2-yl)silane
CID 15373336
2-fluoro-1-(4-methylphenyl)sulfonylindole
CID 14921041
2-chloro-N,N-dimethylindole-1-sulfonamide
CID 143864173
1-(benzenesulfonyl)-2-chloroindole
CID 14416100
trimethyl-(2-trimethylsilylphenyl)silane
CID 519794
1-(2-bromophenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole
CID 11305426
1-(benzenesulfonyl)indole-2-carbonyl chloride
CID 2776221

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane?
The IUPAC name of trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane (CID 12733310) is trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane.
What is the SMILES notation for trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane?
The canonical SMILES for trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane is C[Si](C)(C)c1ccccc1S(=O)(=O)n1c([Si](C)(C)C)cc2ccccc21.
What is the InChIKey of trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane?
The InChIKey is WQDVWBMMJMDALJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27NO2SSi2/c1-25(2,3)19-14-10-9-13-18(19)24(22,23)21-17-12-8-7-11-16(17)15-20(21)26(4,5)6/h7-15H,1-6H3.
What are the key properties of trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane?
trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane has a molecular weight of 401.68 g/mol, XLogP of 3.97, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(2-trimethylsilylindol-1-yl)sulfonylphenyl]silane is sourced from PubChem (CID 12733310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).