KST-1A8065
TL;DR: KST-1A8065 (CAS 742-79-0) is a chemical compound with molecular formula C20H26BrFO2 and molecular weight 396.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9R,10S,11S,13S,14S,17S)-9-bromo-11-fluoro-17-hydroxy-10,13,17-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Also Known As: KST-1A8065, (11, A,17, A)-9-bromo-11-fluoro-17-hydroxy-17-methylandrosta-1,4-dien-3-one, 2(1H)-Naphthalenone,8a-(acetyloxy)octahydro-4a-methyl-,trans
| Molecular Formula | C20H26BrFO2 |
|---|---|
| Molecular Weight | 396.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 396.11002 |
| Heavy Atoms | 24 |
| Complexity | 673.0 |
Chemical Identifiers
| CAS Number | 742-79-0 |
|---|---|
| SMILES | C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)Br)F)C)O |
| InChIKey | YONXONMPECKFJO-RBZZARIASA-N |
Product Overview
KST-1A8065 (CAS 742-79-0), with molecular formula C20H26BrFO2 and molecular weight 396.11 g/mol. IUPAC: (8S,9R,10S,11S,13S,14S,17S)-9-bromo-11-fluoro-17-hydroxy-10,13,17-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of KST-1A8065
Property Insights of KST-1A8065
The XLogP value of 4.0 indicates that KST-1A8065 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, KST-1A8065 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A8065 has 1 hydrogen bond donor(s) and 3 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-1A8065?
The CAS number of KST-1A8065 is 742-79-0.
What is the molecular formula of KST-1A8065?
The molecular formula of KST-1A8065 is C20H26BrFO2.
What is the molecular weight of KST-1A8065?
The molecular weight of KST-1A8065 is 396.11 g/mol.
Where can I buy KST-1A8065?
You can request a quote for KST-1A8065 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A8065?
Yes, KEHONG BIO provides custom synthesis services for KST-1A8065 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.