About CID 19973573
CID 19973573 (PubChem CID 19973573) has the molecular formula C27H24N2OSi2
and a molecular weight of 448.67 g/mol.
Molecular Properties
| Compound Name | CID 19973573 |
| PubChem CID | 19973573 |
| Molecular Formula | C27H24N2OSi2 |
| Molecular Weight | 448.67 g/mol |
| Exact Mass | 448.14 |
| IUPAC Name | — |
| SMILES | O=C(N[Si]C(c1ccccc1)c1ccccc1)N[Si]C(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C27H24N2OSi2/c30-27(28-31-25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)29-32-26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H,(H2,28,29,30) |
| InChIKey | OJKNCUGJNHEJST-UHFFFAOYSA-N |
| XLogP | 5.10 |
| TPSA | 41.13 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 32 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 448.67 |
| LogP ≤ 5 | 5.10 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of CID 19973573?
The IUPAC name of CID 19973573 (CID 19973573) is not available.
What is the SMILES notation for CID 19973573?
The canonical SMILES for CID 19973573 is O=C(N[Si]C(c1ccccc1)c1ccccc1)N[Si]C(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 19973573?
The InChIKey is OJKNCUGJNHEJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2OSi2/c30-27(28-31-25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)29-32-26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H,(H2,28,29,30).
What are the key properties of CID 19973573?
CID 19973573 has a molecular weight of 448.67 g/mol, XLogP of 5.10, 8 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19973573 is sourced from PubChem (CID 19973573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).