[(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium
TL;DR: [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium (CAS 499-48-9) is a chemical compound with molecular formula C13H26N2O3 and molecular weight 258.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium
Also Known As: Cycleanine, (2s,3s)-4-methoxy-3-[(z)-oct-1-en-1-yl-onn-azoxy]butan-2-ol, [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium
| Molecular Formula | C13H26N2O3 |
|---|---|
| Molecular Weight | 258.19 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 258.19434 |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 499-48-9 |
|---|---|
| SMILES | CCCCCCC=C[N+](=N[C@@H](COC)[C@H](C)O)[O-] |
| InChIKey | BCPWSYQGYBTINM-STQMWFEESA-N |
Product Overview
[(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium (CAS 499-48-9), with molecular formula C13H26N2O3 and molecular weight 258.19 g/mol. IUPAC: [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium.
Chemical Property Profile of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium
Property Insights of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium. Following Lipinski's Rule of Five, [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium has 1 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 [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium?
The CAS number of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium is 499-48-9.
What is the molecular formula of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium?
The molecular formula of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium is C13H26N2O3.
What is the molecular weight of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium?
The molecular weight of [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium is 258.19 g/mol.
Where can I buy [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium?
You can request a quote for [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium?
Yes, KEHONG BIO provides custom synthesis services for [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-oct-1-enyl-oxidoazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.