Minopafant ion
TL;DR: Minopafant ion (CAS 760911-49-7) is a chemical compound with molecular formula C46H73N4O9+ and molecular weight 825.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate
Also Known As: Minopafant ion, Minopafant cation, E-5880, 2-[2-Methoxybenzoyl[(R)-2-methoxy-3-[4-(N-stearylcarbamoyloxy)-piperidinocarbonyloxy]propoxycarbonyl]aminomethyl]-1-ethylpyridinium, [(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate
| Molecular Formula | C46H73N4O9+ |
|---|---|
| Molecular Weight | 825.54 g/mol |
| LogP | 11.4 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 31 |
| Exact Mass | 825.5378 |
| Heavy Atoms | 59 |
| Complexity | 1150.0 |
Chemical Identifiers
| CAS Number | 760911-49-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)OC1CCN(CC1)C(=O)OC[C@H](COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3OC)OC |
| InChIKey | HGOAIWZFTWACBD-RRHRGVEJSA-O |
Product Overview
Minopafant ion (CAS 760911-49-7), with molecular formula C46H73N4O9+ and molecular weight 825.54 g/mol. IUPAC: [(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate.
Chemical Property Profile of Minopafant ion
Property Insights of Minopafant ion
The XLogP value of 11.4 indicates that Minopafant ion is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Minopafant ion. Following Lipinski's Rule of Five, Minopafant ion has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Minopafant ion?
The CAS number of Minopafant ion is 760911-49-7.
What is the molecular formula of Minopafant ion?
The molecular formula of Minopafant ion is C46H73N4O9+.
What is the molecular weight of Minopafant ion?
The molecular weight of Minopafant ion is 825.54 g/mol.
Where can I buy Minopafant ion?
You can request a quote for Minopafant ion directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Minopafant ion?
Yes, KEHONG BIO provides custom synthesis services for Minopafant ion and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.