凯布宗
TL;DR: 凯布宗 (CAS 853-34-9) is a chemical compound with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
凯布宗
4-(3-oxobutyl)-1,2-diphenylpyrazolidine-3,5-dione
Also Known As: KEBUZONE, ketophenylbutazone, Chebutan, Chetazolidin, Chepirol
| Molecular Formula | C19H18N2O3 |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.13174 |
| Heavy Atoms | 24 |
| Complexity | 457.0 |
| Solubility | 0.174 mg/mL at 20 °C |
Chemical Identifiers
| CAS Number | 853-34-9 |
|---|---|
| SMILES | CC(=O)CCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | LGYTZKPVOAIUKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
凯布宗 (CAS 853-34-9), with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol. IUPAC: 4-(3-oxobutyl)-1,2-diphenylpyrazolidine-3,5-dione.
Chemical Property Profile of 凯布宗
Property Insights of 凯布宗
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 凯布宗. With a topological polar surface area (TPSA) of 57.7 Ų, 凯布宗 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Kebuzone has 0 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 Kebuzone?
The CAS number of Kebuzone is 853-34-9.
What is the molecular formula of Kebuzone?
The molecular formula of Kebuzone is C19H18N2O3.
What is the molecular weight of Kebuzone?
The molecular weight of Kebuzone is 322.13 g/mol.
Where can I buy Kebuzone?
You can request a quote for Kebuzone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kebuzone?
Yes, KEHONG BIO provides custom synthesis services for Kebuzone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.