KST-1A2124
TL;DR: KST-1A2124 (CAS 178980-00-2) is a chemical compound with molecular formula C23H31BrO5 and molecular weight 466.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8R,9S,10R,13S,14S,16S,17R)-16-bromo-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: KST-1A2124, 5-Fluor-2-chlor-1,3-dimethyl-benzol, (16, A)-16-bromo-17-hydroxy-3,20-dioxopregn-4-en-21-yl acetate, [2-[(8R,9S,10R,13S,14S,16S,17R)-16-bromo-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
| Molecular Formula | C23H31BrO5 |
|---|---|
| Molecular Weight | 466.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.1355 |
| Heavy Atoms | 29 |
| Complexity | 790.0 |
Chemical Identifiers
| CAS Number | 178980-00-2 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@]1([C@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)Br)O |
| InChIKey | PWVPSOWELFUEGX-YYXSXRTQSA-N |
Product Overview
KST-1A2124 (CAS 178980-00-2), with molecular formula C23H31BrO5 and molecular weight 466.14 g/mol. IUPAC: [2-[(8R,9S,10R,13S,14S,16S,17R)-16-bromo-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of KST-1A2124
Property Insights of KST-1A2124
The XLogP value of 3.0 indicates that KST-1A2124 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 KST-1A2124. Following Lipinski's Rule of Five, KST-1A2124 has 1 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 KST-1A2124?
The CAS number of KST-1A2124 is 178980-00-2.
What is the molecular formula of KST-1A2124?
The molecular formula of KST-1A2124 is C23H31BrO5.
What is the molecular weight of KST-1A2124?
The molecular weight of KST-1A2124 is 466.14 g/mol.
Where can I buy KST-1A2124?
You can request a quote for KST-1A2124 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2124?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2124 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.