Skip to content

[(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane

C32H58S2Si2 — CID 102399135

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC[(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane
SMILESCC(C)(C)C1=CC(C(C)(C)C)=C(SSC2=C(C(C)(C)C)C=C(C(C)(C)C)[C@@H]2[Si](C)(C)C)[C@@H]1[Si](C)(C)C
InChIInChI=1S/C32H58S2Si2/c1-29(2,3)21-19-23(31(7,8)9)27(35(13,14)15)25(21)33-34-26-22(30(4,5)6)20-24(32(10,11)12)28(26)36(16,17)18/h19-20,27-28H,1-18H3/t27-,28+
InChIKeyHZCNHJVVQMAZNF-HNRBIFIRSA-N
MW563.12 g/mol
LogP12.36
Rot. Bonds5

About [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane

[(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane (PubChem CID 102399135) has the molecular formula C32H58S2Si2 and a molecular weight of 563.12 g/mol. Its IUPAC name is [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane
PubChem CID102399135
Molecular FormulaC32H58S2Si2
Molecular Weight563.12 g/mol
Exact Mass562.35
IUPAC Name[(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane
SMILESCC(C)(C)C1=CC(C(C)(C)C)=C(SSC2=C(C(C)(C)C)C=C(C(C)(C)C)[C@@H]2[Si](C)(C)C)[C@@H]1[Si](C)(C)C
InChIInChI=1S/C32H58S2Si2/c1-29(2,3)21-19-23(31(7,8)9)27(35(13,14)15)25(21)33-34-26-22(30(4,5)6)20-24(32(10,11)12)28(26)36(16,17)18/h19-20,27-28H,1-18H3/t27-,28+
InChIKeyHZCNHJVVQMAZNF-HNRBIFIRSA-N
XLogP12.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.12
LogP ≤ 512.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane 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 [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
The IUPAC name of [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane (CID 102399135) is [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane.
What is the SMILES notation for [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
The canonical SMILES for [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane is CC(C)(C)C1=CC(C(C)(C)C)=C(SSC2=C(C(C)(C)C)C=C(C(C)(C)C)[C@@H]2[Si](C)(C)C)[C@@H]1[Si](C)(C)C.
What is the InChIKey of [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
The InChIKey is HZCNHJVVQMAZNF-HNRBIFIRSA-N. The full InChI is InChI=1S/C32H58S2Si2/c1-29(2,3)21-19-23(31(7,8)9)27(35(13,14)15)25(21)33-34-26-22(30(4,5)6)20-24(32(10,11)12)28(26)36(16,17)18/h19-20,27-28H,1-18H3/t27-,28+.
What are the key properties of [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
[(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane has a molecular weight of 563.12 g/mol, XLogP of 12.36, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-3,5-ditert-butyl-2-[[(5S)-2,4-ditert-butyl-5-trimethylsilylcyclopenta-1,3-dien-1-yl]disulfanyl]cyclopenta-2,4-dien-1-yl]-trimethylsilane is sourced from PubChem (CID 102399135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.