KST-1A5100
TL;DR: KST-1A5100 (CAS 5006-44-0) is a chemical compound with molecular formula C22H31FO4 and molecular weight 378.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11S,13S,14S,17R)-17-(2-fluoroacetyl)-11,17-dihydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: KST-1A5100, FDA 0066, SK 22937, Progesterone,17-dihydroxy-6.alpha.-methyl-, 21-Fluoro-11,17-dihydroxy-6-methylpregn-4-ene-3,20-dione
| Molecular Formula | C22H31FO4 |
|---|---|
| Molecular Weight | 378.22 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.22064 |
| Heavy Atoms | 27 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 5006-44-0 |
|---|---|
| SMILES | CC1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)CC4)C)O)C)(C(=O)CF)O |
| InChIKey | AQKQDPGSWSFRHL-UWKORSIYSA-N |
Product Overview
KST-1A5100 (CAS 5006-44-0), with molecular formula C22H31FO4 and molecular weight 378.22 g/mol. IUPAC: (8S,9S,10R,11S,13S,14S,17R)-17-(2-fluoroacetyl)-11,17-dihydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of KST-1A5100
Property Insights of KST-1A5100
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A5100. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A5100. Following Lipinski's Rule of Five, KST-1A5100 has 2 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-1A5100?
The CAS number of KST-1A5100 is 5006-44-0.
What is the molecular formula of KST-1A5100?
The molecular formula of KST-1A5100 is C22H31FO4.
What is the molecular weight of KST-1A5100?
The molecular weight of KST-1A5100 is 378.22 g/mol.
Where can I buy KST-1A5100?
You can request a quote for KST-1A5100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A5100?
Yes, KEHONG BIO provides custom synthesis services for KST-1A5100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.