KST-1A5864
TL;DR: KST-1A5864 (CAS 5108-93-0) is a chemical compound with molecular formula C20H28N2O and molecular weight 312.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,9S,12S,13R,16S)-9,13-dimethyl-6,7-diazapentacyclo[10.8.0.02,9.04,8.013,18]icosa-4(8),5,18-trien-16-ol
Also Known As: KST-1A5864, (2s,4ar,4bs,6as,10as,10br)-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,7,10,10a,10b,11-tetradecahydronaphtho[2',1':4,5]indeno[1,2-c]pyrazol-2-ol, J1.693.504B, 3beta-Hydroxy-androst-5-eno[17,16-c]pyrazole, 1'(2')H-androst-5-eno[17,16-c]pyrazol-3-ol
| Molecular Formula | C20H28N2O |
|---|---|
| Molecular Weight | 312.22 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.22015 |
| Heavy Atoms | 23 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 5108-93-0 |
|---|---|
| SMILES | C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC5=C4NN=C5)C)O |
| InChIKey | NLDGHLGLNVFXFH-KCMORZRYSA-N |
Product Overview
KST-1A5864 (CAS 5108-93-0), with molecular formula C20H28N2O and molecular weight 312.22 g/mol. IUPAC: (1R,2S,9S,12S,13R,16S)-9,13-dimethyl-6,7-diazapentacyclo[10.8.0.02,9.04,8.013,18]icosa-4(8),5,18-trien-16-ol.
Chemical Property Profile of KST-1A5864
Property Insights of KST-1A5864
The XLogP value of 3.5 indicates that KST-1A5864 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.9 Ų, KST-1A5864 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A5864 has 2 hydrogen bond donor(s) and 2 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-1A5864?
The CAS number of KST-1A5864 is 5108-93-0.
What is the molecular formula of KST-1A5864?
The molecular formula of KST-1A5864 is C20H28N2O.
What is the molecular weight of KST-1A5864?
The molecular weight of KST-1A5864 is 312.22 g/mol.
Where can I buy KST-1A5864?
You can request a quote for KST-1A5864 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A5864?
Yes, KEHONG BIO provides custom synthesis services for KST-1A5864 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.