[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane

C32H52S3Si2 — CID 101486953

IUPAC[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
SMILESCCCCCCCC[Si](C)(C)c1ccc(-c2ccc(-c3ccc([Si](C)(C)CCCCCCCC)s3)s2)s1
InChIInChI=1S/C32H52S3Si2/c1-7-9-11-13-15-17-25-36(3,4)31-23-21-29(34-31)27-19-20-28(33-27)30-22-24-32(35-30)37(5,6)26-18-16-14-12-10-8-2/h19-24H,7-18,25-26H2,1-6H3
InChIKeyOACCCODPTWBPEC-UHFFFAOYSA-N
MW589.14 g/mol
LogP11.76
Rot. Bonds18

About [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane

[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane (PubChem CID 101486953) has the molecular formula C32H52S3Si2 and a molecular weight of 589.14 g/mol. Its IUPAC name is [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane.

Molecular Properties

Compound Name[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
PubChem CID101486953
Molecular FormulaC32H52S3Si2
Molecular Weight589.14 g/mol
Exact Mass588.28
IUPAC Name[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
SMILESCCCCCCCC[Si](C)(C)c1ccc(-c2ccc(-c3ccc([Si](C)(C)CCCCCCCC)s3)s2)s1
InChIInChI=1S/C32H52S3Si2/c1-7-9-11-13-15-17-25-36(3,4)31-23-21-29(34-31)27-19-20-28(33-27)30-22-24-32(35-30)37(5,6)26-18-16-14-12-10-8-2/h19-24H,7-18,25-26H2,1-6H3
InChIKeyOACCCODPTWBPEC-UHFFFAOYSA-N
XLogP11.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500589.14
LogP ≤ 511.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane 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

[5-[5-[5-[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
CID 101486956
2-dodecyl-5-[5-[5-[5-[5-(5-dodecylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophene
CID 24746397
tetrakis[2-[dimethyl-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]silyl]ethyl]silane
CID 101345806
trichloro-[5-[5-[5-(5-hexylsulfanylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]silane
CID 59687604
icosyl-dimethyl-phenylsilane
CID 91054385
2-dodecyl-5-[5-[2,3,4,5,6-pentakis[5-(5-dodecylthiophen-2-yl)thiophen-2-yl]phenyl]thiophen-2-yl]thiophene
CID 101109939
bis[5-[5-[bis[5-(5-hexylthiophen-2-yl)thiophen-2-yl]-methylsilyl]thiophen-2-yl]thiophen-2-yl]-methyl-(5-thiophen-2-ylthiophen-2-yl)silane
CID 102519870
dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane
CID 101060108
dimethyl-octyl-pyridin-3-ylsilane
CID 11196014
2-(3-hexylthiophen-2-yl)-5-[5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
CID 71381559
2,5-bis(5-octylsulfanylthiophen-2-yl)thiophene
CID 71361773
2,5-bis[5-[5-[5-(5-nonadecan-9-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophene
CID 135005982

Frequently Asked Questions

What is the IUPAC name of [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane?
The IUPAC name of [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane (CID 101486953) is [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane.
What is the SMILES notation for [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane?
The canonical SMILES for [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane is CCCCCCCC[Si](C)(C)c1ccc(-c2ccc(-c3ccc([Si](C)(C)CCCCCCCC)s3)s2)s1.
What is the InChIKey of [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane?
The InChIKey is OACCCODPTWBPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H52S3Si2/c1-7-9-11-13-15-17-25-36(3,4)31-23-21-29(34-31)27-19-20-28(33-27)30-22-24-32(35-30)37(5,6)26-18-16-14-12-10-8-2/h19-24H,7-18,25-26H2,1-6H3.
What are the key properties of [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane?
[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane has a molecular weight of 589.14 g/mol, XLogP of 11.76, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane is sourced from PubChem (CID 101486953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).