Roxibolone
TL;DR: Roxibolone (CAS 60023-92-9) is a chemical compound with molecular formula C21H28O5 and molecular weight 360.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13,17-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2-carboxylic acid
Also Known As: Roxibolone, Roxibolonum, roxibolona, Roxibolono, Roxibolone [INN]
| Molecular Formula | C21H28O5 |
|---|---|
| Molecular Weight | 360.19 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.19366 |
| Heavy Atoms | 26 |
| Complexity | 752.0 |
Chemical Identifiers
| CAS Number | 60023-92-9 |
|---|---|
| SMILES | C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C(=C[C@]34C)C(=O)O)O)C)O |
| InChIKey | JOFBZBDWOWPUMO-QARKFJNLSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Roxibolone (CAS 60023-92-9), with molecular formula C21H28O5 and molecular weight 360.19 g/mol. IUPAC: (8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13,17-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2-carboxylic acid.
Chemical Property Profile of Roxibolone
Property Insights of Roxibolone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Roxibolone. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Roxibolone. Following Lipinski's Rule of Five, Roxibolone has 3 hydrogen bond donor(s) and 5 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 Roxibolone?
The CAS number of Roxibolone is 60023-92-9.
What is the molecular formula of Roxibolone?
The molecular formula of Roxibolone is C21H28O5.
What is the molecular weight of Roxibolone?
The molecular weight of Roxibolone is 360.19 g/mol.
Where can I buy Roxibolone?
You can request a quote for Roxibolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Roxibolone?
Yes, KEHONG BIO provides custom synthesis services for Roxibolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.