Pircophen
TL;DR: Pircophen (CAS 8075-94-3) is a chemical compound with molecular formula C31H40N8O5 and molecular weight 604.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione
Also Known As: Pircophen, Pyrcophen, Aminopyrine mixture with caffeine and phenacetin, SID:134222310, 4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one,N-(4-ethoxyphenyl)acetamide,1,3,7-trimethylpurine-2,6-dione
| Molecular Formula | C31H40N8O5 |
|---|---|
| Molecular Weight | 604.31 g/mol |
| LogP | 2.56482 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 604.3122 |
| Heavy Atoms | 44 |
| Complexity | 798.0 |
Chemical Identifiers
| CAS Number | 8075-94-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C.CN1C=NC2=C1C(=O)N(C(=O)N2C)C |
| InChIKey | CSYGDFOVWMCVDH-UHFFFAOYSA-N |
Product Overview
Pircophen (CAS 8075-94-3), with molecular formula C31H40N8O5 and molecular weight 604.31 g/mol. IUPAC: 4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione.
Chemical Property Profile of Pircophen
Property Insights of Pircophen
The XLogP value of 2.56482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pircophen. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pircophen. Following Lipinski's Rule of Five, Pircophen has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pircophen?
The CAS number of Pircophen is 8075-94-3.
What is the molecular formula of Pircophen?
The molecular formula of Pircophen is C31H40N8O5.
What is the molecular weight of Pircophen?
The molecular weight of Pircophen is 604.31 g/mol.
Where can I buy Pircophen?
You can request a quote for Pircophen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pircophen?
Yes, KEHONG BIO provides custom synthesis services for Pircophen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.