Caffeine mixture with phenacetin, propyphenazone and pyrithyldione
TL;DR: Caffeine mixture with phenacetin, propyphenazone and pyrithyldione (CAS 8064-93-5) is a chemical compound with molecular formula C41H54N8O7 and molecular weight 770.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethyl-1H-pyridine-2,4-dione;1,5-dimethyl-2-phenyl-4-propan-2-ylpyrazol-3-one;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione
Also Known As: Saridon, Caffeine mixture with phenacetin, propyphenazone and pyrithyldione, 3,3-diethyl-1H-pyridine-2,4-dione;1,5-dimethyl-2-phenyl-4-propan-2-ylpyrazol-3-one;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione, 3,3-diethyl-1H-pyridine-2,4-dione; 1,5-dimethyl-2-phenyl-4-propan-2-ylpyrazol-3-one; N-(4-ethoxyphenyl)acetamide; 1,3,7-trimethylpurine-2,6-dione, Acetamide, N-(4-ethoxyphenyl)-, mixt. with 3,3-diethyl-2,4(1H,3H)-pyridinedione, 1,2-dihydro-1,5-dimethyl-4-(1-methylethyl)-2-phenyl-3H-pyrazol-3-one and 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
| Molecular Formula | C41H54N8O7 |
|---|---|
| Molecular Weight | 770.41 g/mol |
| LogP | 4.62762 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 770.41156 |
| Heavy Atoms | 56 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 8064-93-5 |
|---|---|
| SMILES | CCC1(C(=O)C=CNC1=O)CC.CCOC1=CC=C(C=C1)NC(=O)C.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C)C.CN1C=NC2=C1C(=O)N(C(=O)N2C)C |
| InChIKey | FTXBYPJTBQIVJL-UHFFFAOYSA-N |
Product Overview
Caffeine mixture with phenacetin, propyphenazone and pyrithyldione (CAS 8064-93-5), with molecular formula C41H54N8O7 and molecular weight 770.41 g/mol. IUPAC: 3,3-diethyl-1H-pyridine-2,4-dione;1,5-dimethyl-2-phenyl-4-propan-2-ylpyrazol-3-one;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione.
Chemical Property Profile of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione
Property Insights of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione
The XLogP value of 4.62762 indicates that Caffeine mixture with phenacetin, propyphenazone and pyrithyldione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.0 Ų indicates high polarity, suggesting Caffeine mixture with phenacetin, propyphenazone and pyrithyldione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Caffeine mixture with phenacetin, propyphenazone and pyrithyldione has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione?
The CAS number of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione is 8064-93-5.
What is the molecular formula of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione?
The molecular formula of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione is C41H54N8O7.
What is the molecular weight of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione?
The molecular weight of Caffeine mixture with phenacetin, propyphenazone and pyrithyldione is 770.41 g/mol.
Where can I buy Caffeine mixture with phenacetin, propyphenazone and pyrithyldione?
You can request a quote for Caffeine mixture with phenacetin, propyphenazone and pyrithyldione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Caffeine mixture with phenacetin, propyphenazone and pyrithyldione?
Yes, KEHONG BIO provides custom synthesis services for Caffeine mixture with phenacetin, propyphenazone and pyrithyldione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.