KST-1A3829
TL;DR: KST-1A3829 (CAS 2711-45-7) is a chemical compound with molecular formula C22H27FO4 and molecular weight 374.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6S,8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11-hydroxy-6,10,13-trimethylspiro[6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17,2'-oxetane]-3,3'-dione
Also Known As: KST-1A3829, (6, A,11, A)-9-fluoro-11-hydroxy-6-methyl-17,21-epoxypregna-1,4-diene-3,20-dione, (6S,8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11-hydroxy-6,10,13-trimethylspiro[6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17,2'-oxetane]-3,3'-dione
| Molecular Formula | C22H27FO4 |
|---|---|
| Molecular Weight | 374.19 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 374.18933 |
| Heavy Atoms | 27 |
| Complexity | 817.0 |
Chemical Identifiers
| CAS Number | 2711-45-7 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3CC[C@@]4([C@]3(C[C@@H]([C@@]2([C@@]5(C1=CC(=O)C=C5)C)F)O)C)C(=O)CO4 |
| InChIKey | UAELTFMDOIYQJQ-MJWISQFFSA-N |
Product Overview
KST-1A3829 (CAS 2711-45-7), with molecular formula C22H27FO4 and molecular weight 374.19 g/mol. IUPAC: (6S,8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11-hydroxy-6,10,13-trimethylspiro[6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17,2'-oxetane]-3,3'-dione.
Chemical Property Profile of KST-1A3829
Property Insights of KST-1A3829
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A3829. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A3829. Following Lipinski's Rule of Five, KST-1A3829 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-1A3829?
The CAS number of KST-1A3829 is 2711-45-7.
What is the molecular formula of KST-1A3829?
The molecular formula of KST-1A3829 is C22H27FO4.
What is the molecular weight of KST-1A3829?
The molecular weight of KST-1A3829 is 374.19 g/mol.
Where can I buy KST-1A3829?
You can request a quote for KST-1A3829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A3829?
Yes, KEHONG BIO provides custom synthesis services for KST-1A3829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.