5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione

C36H32N2O2Si — CID 140848438

IUPAC5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione
SMILESCC(C)N1C(=O)N([Si](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C36H32N2O2Si/c1-28(2)37-35(40)38(34(39)36(37,29-18-8-3-9-19-29)30-20-10-4-11-21-30)41(31-22-12-5-13-23-31,32-24-14-6-15-25-32)33-26-16-7-17-27-33/h3-28H,1-2H3
InChIKeyWOXOQAUYJHELRA-UHFFFAOYSA-N
MW552.75 g/mol
LogP5.27
Rot. Bonds7

About 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione

5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione (PubChem CID 140848438) has the molecular formula C36H32N2O2Si and a molecular weight of 552.75 g/mol. Its IUPAC name is 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione
PubChem CID140848438
Molecular FormulaC36H32N2O2Si
Molecular Weight552.75 g/mol
Exact Mass552.22
IUPAC Name5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione
SMILESCC(C)N1C(=O)N([Si](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C36H32N2O2Si/c1-28(2)37-35(40)38(34(39)36(37,29-18-8-3-9-19-29)30-20-10-4-11-21-30)41(31-22-12-5-13-23-31,32-24-14-6-15-25-32)33-26-16-7-17-27-33/h3-28H,1-2H3
InChIKeyWOXOQAUYJHELRA-UHFFFAOYSA-N
XLogP5.27
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500552.75
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione?
The IUPAC name of 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione (CID 140848438) is 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione.
What is the SMILES notation for 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione?
The canonical SMILES for 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione is CC(C)N1C(=O)N([Si](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)C1(c1ccccc1)c1ccccc1.
What is the InChIKey of 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione?
The InChIKey is WOXOQAUYJHELRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H32N2O2Si/c1-28(2)37-35(40)38(34(39)36(37,29-18-8-3-9-19-29)30-20-10-4-11-21-30)41(31-22-12-5-13-23-31,32-24-14-6-15-25-32)33-26-16-7-17-27-33/h3-28H,1-2H3.
What are the key properties of 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione?
5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione has a molecular weight of 552.75 g/mol, XLogP of 5.27, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diphenyl-1-propan-2-yl-3-triphenylsilylimidazolidine-2,4-dione is sourced from PubChem (CID 140848438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).