三氟甲磺酸銅
TL;DR: 三氟甲磺酸銅 (CAS 34946-82-2) is a chemical compound with molecular formula C24H31ClO7 and molecular weight 466.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三氟甲磺酸銅
chloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-17-carboxylate
Also Known As: Loteprednol etabonate, Lotemax, Alrex, loteprednol, Inveltys
| Molecular Formula | C24H31ClO7 |
|---|---|
| Molecular Weight | 466.18 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.17584 |
| Heavy Atoms | 32 |
| Complexity | 882.0 |
Chemical Identifiers
| CAS Number | 34946-82-2 |
|---|---|
| SMILES | CCOC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)C(=O)OCCl |
| InChIKey | DMKSVUSAATWOCU-HROMYWEYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三氟甲磺酸銅 (CAS 34946-82-2), with molecular formula C24H31ClO7 and molecular weight 466.18 g/mol. IUPAC: chloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-17-carboxylate.
Chemical Property Profile of 三氟甲磺酸銅
Property Insights of 三氟甲磺酸銅
The XLogP value of 3.9 indicates that 三氟甲磺酸銅 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 三氟甲磺酸銅. Following Lipinski's Rule of Five, 三氟甲磺酸銅 has 1 hydrogen bond donor(s) and 7 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 三氟甲磺酸銅?
The CAS number of 三氟甲磺酸銅 is 34946-82-2.
What is the molecular formula of 三氟甲磺酸銅?
The molecular formula of 三氟甲磺酸銅 is C24H31ClO7.
What is the molecular weight of 三氟甲磺酸銅?
The molecular weight of 三氟甲磺酸銅 is 466.18 g/mol.
Where can I buy 三氟甲磺酸銅?
You can request a quote for 三氟甲磺酸銅 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三氟甲磺酸銅?
Yes, KEHONG BIO provides custom synthesis services for 三氟甲磺酸銅 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.