二唑丁酮
TL;DR: 二唑丁酮 (CAS 38083-17-9) is a chemical compound with molecular formula C15H17ClN2O2 and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二唑丁酮
1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one
Also Known As: Climbazole, Climbazol, Baypival, Baysan, Crinipan AD
| Molecular Formula | C15H17ClN2O2 |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.09787 |
| Heavy Atoms | 20 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 38083-17-9 |
|---|---|
| SMILES | CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl |
| InChIKey | OWEGWHBOCFMBLP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二唑丁酮 (CAS 38083-17-9), with molecular formula C15H17ClN2O2 and molecular weight 292.10 g/mol. IUPAC: 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one.
Chemical Property Profile of 二唑丁酮
Property Insights of 二唑丁酮
The XLogP value of 3.7 indicates that 二唑丁酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.1 Ų, 二唑丁酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二唑丁酮 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 二唑丁酮?
The CAS number of 二唑丁酮 is 38083-17-9.
What is the molecular formula of 二唑丁酮?
The molecular formula of 二唑丁酮 is C15H17ClN2O2.
What is the molecular weight of 二唑丁酮?
The molecular weight of 二唑丁酮 is 292.10 g/mol.
Where can I buy 二唑丁酮?
You can request a quote for 二唑丁酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二唑丁酮?
Yes, KEHONG BIO provides custom synthesis services for 二唑丁酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.