Conopharyngine
TL;DR: Conopharyngine (CAS 76-98-2) is a chemical compound with molecular formula C23H30N2O4 and molecular weight 398.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,17S,18S)-17-ethyl-6,7-dimethoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
Also Known As: Conopharyngine, Conopharyngine (iboga), 18-Carbomethoxy-12,13-dimethoxyibogamine, 4-25-00-01286 (Beilstein Handbook Reference), Ibogamine-18-carboxylic acid, 12,13-dimethoxy-, methyl ester
| Molecular Formula | C23H30N2O4 |
|---|---|
| Molecular Weight | 398.22 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 63.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.22055 |
| Heavy Atoms | 29 |
| Complexity | 644.0 |
Chemical Identifiers
| CAS Number | 76-98-2 |
|---|---|
| SMILES | CC[C@H]1CC2C[C@@]3([C@H]1N(C2)CCC4=C3NC5=CC(=C(C=C45)OC)OC)C(=O)OC |
| InChIKey | DUFLXLVGASPEMV-COUHDALUSA-N |
Product Overview
Conopharyngine (CAS 76-98-2), with molecular formula C23H30N2O4 and molecular weight 398.22 g/mol. IUPAC: methyl (1S,17S,18S)-17-ethyl-6,7-dimethoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate.
Chemical Property Profile of Conopharyngine
Property Insights of Conopharyngine
The XLogP value of 3.5 indicates that Conopharyngine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Conopharyngine. Following Lipinski's Rule of Five, Conopharyngine has 1 hydrogen bond donor(s) and 5 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 Conopharyngine?
The CAS number of Conopharyngine is 76-98-2.
What is the molecular formula of Conopharyngine?
The molecular formula of Conopharyngine is C23H30N2O4.
What is the molecular weight of Conopharyngine?
The molecular weight of Conopharyngine is 398.22 g/mol.
Where can I buy Conopharyngine?
You can request a quote for Conopharyngine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Conopharyngine?
Yes, KEHONG BIO provides custom synthesis services for Conopharyngine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.