KST-1A8559
TL;DR: KST-1A8559 (CAS 85099-00-9) is a chemical compound with molecular formula C22H39NO4S and molecular weight 413.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexylcyclohexanamine;(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methanesulfonic acid
Also Known As: KST-1A8559, (7,7-Dimethyl-2-oxobicyclo(2.2.1)hept-1-yl)methanesulfonic acid compound with N-cyclohexylcyclohexanamine (1:1), (7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methanesulfonic acid- n-cyclohexylcyclohexanamine(1:1), N-cyclohexylcyclohexanamine; (7,7-dimethyl-2-oxo-norbornan-1-yl)methanesulfonic acid, (7,7-Dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methanesulfonic acid compound with N-cyclohexylcyclohexanamine (1:1)
| Molecular Formula | C22H39NO4S |
|---|---|
| Molecular Weight | 413.26 g/mol |
| LogP | 4.511 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.25998 |
| Heavy Atoms | 28 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 85099-00-9 |
|---|---|
| SMILES | CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C.C1CCC(CC1)NC2CCCCC2 |
| InChIKey | AVXJIEYQJHLAGP-UHFFFAOYSA-N |
Product Overview
KST-1A8559 (CAS 85099-00-9), with molecular formula C22H39NO4S and molecular weight 413.26 g/mol. IUPAC: N-cyclohexylcyclohexanamine;(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methanesulfonic acid.
Chemical Property Profile of KST-1A8559
Property Insights of KST-1A8559
The XLogP value of 4.511 indicates that KST-1A8559 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A8559. Following Lipinski's Rule of Five, KST-1A8559 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-1A8559?
The CAS number of KST-1A8559 is 85099-00-9.
What is the molecular formula of KST-1A8559?
The molecular formula of KST-1A8559 is C22H39NO4S.
What is the molecular weight of KST-1A8559?
The molecular weight of KST-1A8559 is 413.26 g/mol.
Where can I buy KST-1A8559?
You can request a quote for KST-1A8559 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A8559?
Yes, KEHONG BIO provides custom synthesis services for KST-1A8559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.