Mefeserpine
TL;DR: Mefeserpine (CAS 3735-85-1) is a chemical compound with molecular formula C32H38N2O8 and molecular weight 578.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-[2-(4-methoxyphenoxy)acetyl]oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: Mefeserpine, Mefeserpina, Mefeserpinum, Methoxyphenoserpine, Mefeserpine [INN]
| Molecular Formula | C32H38N2O8 |
|---|---|
| Molecular Weight | 578.26 g/mol |
| LogP | 3.9191 |
| Topological Polar Surface Area | 108.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 578.2628 |
| Heavy Atoms | 42 |
| Complexity | 1436.2885 |
Chemical Identifiers
| CAS Number | 3735-85-1 |
|---|---|
| SMILES | CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)COC6=CC=C(C=C6)OC |
Product Overview
Mefeserpine (CAS 3735-85-1), with molecular formula C32H38N2O8 and molecular weight 578.26 g/mol. IUPAC: methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-[2-(4-methoxyphenoxy)acetyl]oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of Mefeserpine
Property Insights of Mefeserpine
The XLogP value of 3.9191 indicates that Mefeserpine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Mefeserpine. Following Lipinski's Rule of Five, Mefeserpine 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 Mefeserpine?
The CAS number of Mefeserpine is 3735-85-1.
What is the molecular formula of Mefeserpine?
The molecular formula of Mefeserpine is C32H38N2O8.
What is the molecular weight of Mefeserpine?
The molecular weight of Mefeserpine is 578.26 g/mol.
Where can I buy Mefeserpine?
You can request a quote for Mefeserpine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mefeserpine?
Yes, KEHONG BIO provides custom synthesis services for Mefeserpine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.