Pseudoyohimbine
TL;DR: Pseudoyohimbine (CAS 85824-40-4) is a chemical compound with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: PSEUDOYOHIMBINE, .psi.-Yohimbine, Pseudoyohimbin, 3-Epialloyohimbine, 3-EPIYOHIMBINE
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 85824-40-4 |
|---|---|
| SMILES | COC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O |
| InChIKey | BLGXFZZNTVWLAY-AECJZGCLSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pseudoyohimbine (CAS 85824-40-4), with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol. IUPAC: methyl (1R,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of Pseudoyohimbine
Property Insights of Pseudoyohimbine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudoyohimbine. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudoyohimbine. Following Lipinski's Rule of Five, Pseudoyohimbine has 2 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 Pseudoyohimbine?
The CAS number of Pseudoyohimbine is 85824-40-4.
What is the molecular formula of Pseudoyohimbine?
The molecular formula of Pseudoyohimbine is C21H26N2O3.
What is the molecular weight of Pseudoyohimbine?
The molecular weight of Pseudoyohimbine is 354.19 g/mol.
Where can I buy Pseudoyohimbine?
You can request a quote for Pseudoyohimbine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudoyohimbine?
Yes, KEHONG BIO provides custom synthesis services for Pseudoyohimbine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.