苦马豆碱N-氧化物
TL;DR: 苦马豆碱N-氧化物 (CAS 86449-40-3) is a chemical compound with molecular formula C8H15NO4 and molecular weight 189.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苦马豆碱N-氧化物
(1S,2R,8R,8aR)-4-oxido-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium-1,2,8-triol
Also Known As: Swainsonine N-oxide, KST-1A8619, J2.371.839A, (1s,2r,8r,8ar)octahydroindolizine-1,2,8-triol 4-oxide, (1S,2R,8R,8aR)-4-oxido-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium-1,2,8-triol
| Molecular Formula | C8H15NO4 |
|---|---|
| Molecular Weight | 189.10 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.10011 |
| Heavy Atoms | 13 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 86449-40-3 |
|---|---|
| SMILES | C1C[C@H]([C@@H]2[C@@H]([C@@H](C[N+]2(C1)[O-])O)O)O |
| InChIKey | WXELLRXNGRTSJY-VARJHODCSA-N |
Product Overview
苦马豆碱N-氧化物 (CAS 86449-40-3), with molecular formula C8H15NO4 and molecular weight 189.10 g/mol. IUPAC: (1S,2R,8R,8aR)-4-oxido-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium-1,2,8-triol.
Chemical Property Profile of 苦马豆碱N-氧化物
Property Insights of 苦马豆碱N-氧化物
The XLogP value of -1.8 indicates that 苦马豆碱N-氧化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 苦马豆碱N-氧化物. Following Lipinski's Rule of Five, 苦马豆碱N-氧化物 has 3 hydrogen bond donor(s) and 4 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 苦马豆碱N-氧化物?
The CAS number of 苦马豆碱N-氧化物 is 86449-40-3.
What is the molecular formula of 苦马豆碱N-氧化物?
The molecular formula of 苦马豆碱N-氧化物 is C8H15NO4.
What is the molecular weight of 苦马豆碱N-氧化物?
The molecular weight of 苦马豆碱N-氧化物 is 189.10 g/mol.
Where can I buy 苦马豆碱N-氧化物?
You can request a quote for 苦马豆碱N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苦马豆碱N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 苦马豆碱N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.