羟基保泰松
TL;DR: 羟基保泰松 (CAS 129-20-4) is a chemical compound with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟基保泰松
4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione
Also Known As: oxyphenbutazone, Oxyphenylbutazone, Tandearil, Flogitolo, Flogoril
| Molecular Formula | C19H20N2O3 |
|---|---|
| Molecular Weight | 324.15 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.1474 |
| Heavy Atoms | 24 |
| Complexity | 454.0 |
| Melting Point | 96 |
| Solubility | 60 |
Chemical Identifiers
| CAS Number | 129-20-4 |
|---|---|
| SMILES | CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3 |
| InChIKey | HFHZKZSRXITVMK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟基保泰松 (CAS 129-20-4), with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol. IUPAC: 4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione.
Chemical Property Profile of 羟基保泰松
Property Insights of 羟基保泰松
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 羟基保泰松. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 羟基保泰松. Following Lipinski's Rule of Five, 羟布宗 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 羟布宗?
The CAS number of 羟布宗 is 129-20-4.
What is the molecular formula of 羟布宗?
The molecular formula of 羟布宗 is C19H20N2O3.
What is the molecular weight of 羟布宗?
The molecular weight of 羟布宗 is 324.15 g/mol.
Where can I buy 羟布宗?
You can request a quote for 羟布宗 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟布宗?
Yes, KEHONG BIO provides custom synthesis services for 羟布宗 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.