KST-1A2849
TL;DR: KST-1A2849 (CAS 22518-27-0) is a chemical compound with molecular formula C20H30O3 and molecular weight 318.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8R,9S,10R,13S,14S,17R)-3-hydroxy-17-methoxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one
Also Known As: KST-1A2849, (3, A,17, A)-3-hydroxy-17-methoxyandrost-5-en-16-one, (3S,8R,9S,10R,13S,14S,17R)-3-hydroxy-17-methoxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one
| Molecular Formula | C20H30O3 |
|---|---|
| Molecular Weight | 318.22 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.21948 |
| Heavy Atoms | 23 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 22518-27-0 |
|---|---|
| SMILES | C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC(=O)[C@@H]4OC)C)O |
| InChIKey | CPHLKKWTVVSMIN-HOSJZOFRSA-N |
Product Overview
KST-1A2849 (CAS 22518-27-0), with molecular formula C20H30O3 and molecular weight 318.22 g/mol. IUPAC: (3S,8R,9S,10R,13S,14S,17R)-3-hydroxy-17-methoxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one.
Chemical Property Profile of KST-1A2849
Property Insights of KST-1A2849
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A2849. With a topological polar surface area (TPSA) of 46.5 Ų, KST-1A2849 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A2849 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-1A2849?
The CAS number of KST-1A2849 is 22518-27-0.
What is the molecular formula of KST-1A2849?
The molecular formula of KST-1A2849 is C20H30O3.
What is the molecular weight of KST-1A2849?
The molecular weight of KST-1A2849 is 318.22 g/mol.
Where can I buy KST-1A2849?
You can request a quote for KST-1A2849 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2849?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2849 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.