美索曲明
TL;DR: 美索曲明 (CAS 104807-40-1) is a chemical compound with molecular formula C36H62N4O2 and molecular weight 582.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
美索曲明
N,N'-bis[6-[(2-methoxyphenyl)methylamino]hexyl]octane-1,8-diamine
Also Known As: Methoctramine, Methoctramine free base, Lopac-M-105, Methoctramine tetrahydrochloride, Lopac0_000862
| Molecular Formula | C36H62N4O2 |
|---|---|
| Molecular Weight | 582.49 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 29 |
| Exact Mass | 582.4873 |
| Heavy Atoms | 42 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 104807-40-1 |
|---|---|
| SMILES | COC1=CC=CC=C1CNCCCCCCNCCCCCCCCNCCCCCCNCC2=CC=CC=C2OC |
| InChIKey | RPMBYDYUVKEZJA-UHFFFAOYSA-N |
Product Overview
美索曲明 (CAS 104807-40-1), with molecular formula C36H62N4O2 and molecular weight 582.49 g/mol. IUPAC: N,N'-bis[6-[(2-methoxyphenyl)methylamino]hexyl]octane-1,8-diamine.
Chemical Property Profile of 美索曲明
Property Insights of 美索曲明
The XLogP value of 6.8 indicates that Methoctramine free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 美索曲明. Following Lipinski's Rule of Five, Methoctramine free base has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methoctramine free base?
The CAS number of Methoctramine free base is 104807-40-1.
What is the molecular formula of Methoctramine free base?
The molecular formula of Methoctramine free base is C36H62N4O2.
What is the molecular weight of Methoctramine free base?
The molecular weight of Methoctramine free base is 582.49 g/mol.
Where can I buy Methoctramine free base?
You can request a quote for Methoctramine free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methoctramine free base?
Yes, KEHONG BIO provides custom synthesis services for Methoctramine free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.