Diflucortolone Pivalate
TL;DR: Diflucortolone Pivalate (CAS 15845-96-2) is a chemical compound with molecular formula C27H36F2O5 and molecular weight 478.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate
Also Known As: Diflucortolone pivalate, Difluocortolone pivalate, Diflucortolone pivalate [USAN], SH 968, Diflucortolone pivalate (USAN)
| Molecular Formula | C27H36F2O5 |
|---|---|
| Molecular Weight | 478.25 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 478.25308 |
| Heavy Atoms | 34 |
| Complexity | 980.0 |
Chemical Identifiers
| CAS Number | 15845-96-2 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@H]1C(=O)COC(=O)C(C)(C)C)C)O)F)C)F |
| InChIKey | UWGRWFCLGQWKPR-GSTUPEFVSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diflucortolone Pivalate (CAS 15845-96-2), with molecular formula C27H36F2O5 and molecular weight 478.25 g/mol. IUPAC: [2-[(6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate.
Chemical Property Profile of Diflucortolone Pivalate
Property Insights of Diflucortolone Pivalate
The XLogP value of 4.2 indicates that Diflucortolone Pivalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diflucortolone Pivalate. Following Lipinski's Rule of Five, Diflucortolone Pivalate 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 Diflucortolone Pivalate?
The CAS number of Diflucortolone Pivalate is 15845-96-2.
What is the molecular formula of Diflucortolone Pivalate?
The molecular formula of Diflucortolone Pivalate is C27H36F2O5.
What is the molecular weight of Diflucortolone Pivalate?
The molecular weight of Diflucortolone Pivalate is 478.25 g/mol.
Where can I buy Diflucortolone Pivalate?
You can request a quote for Diflucortolone Pivalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diflucortolone Pivalate?
Yes, KEHONG BIO provides custom synthesis services for Diflucortolone Pivalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.