Oxyphenbutazone monohydrate
TL;DR: Oxyphenbutazone monohydrate (CAS 7081-38-1) is a chemical compound with molecular formula C19H22N2O4 and molecular weight 342.15796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione;hydrate
Also Known As: oxyphenbutazone, Oxyphenbutazone hydrate, Tandearil, Phlogistol, Phlogase
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H22N2O4 |
| Molecular Weight | 342.15796 g/mol |
| XLogP | 2.67 |
| Topological Polar Surface Area (TPSA) | 61.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.15796 Da |
| Heavy Atoms | 25 |
| Complexity | 454.0 |
| SMILES | CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3.O |
| InChIKey | CNDQSXOVEQXJOE-UHFFFAOYSA-N |
Chemical Property Profile of Oxyphenbutazone monohydrate
Property Insights of Oxyphenbutazone monohydrate
The XLogP value of 2.67 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxyphenbutazone monohydrate. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxyphenbutazone monohydrate. Following Lipinski's Rule of Five, Oxyphenbutazone monohydrate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Oxyphenbutazone monohydrate?
The CAS number of Oxyphenbutazone monohydrate is 7081-38-1.
What is the molecular formula of Oxyphenbutazone monohydrate?
The molecular formula of Oxyphenbutazone monohydrate is C19H22N2O4.
What is the molecular weight of Oxyphenbutazone monohydrate?
The molecular weight of Oxyphenbutazone monohydrate is 342.15796 g/mol.
Where can I buy Oxyphenbutazone monohydrate?
You can request a quote for Oxyphenbutazone monohydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Oxyphenbutazone monohydrate?
Yes, CoreyChem provides custom synthesis services for Oxyphenbutazone monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.