Corynantheine hydrochloride
TL;DR: Corynantheine hydrochloride (CAS 5986-06-1) is a chemical compound with molecular formula C22H27ClN2O3 and molecular weight 402.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-2-[(2S,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate;hydrochloride
Also Known As: Corynantheine hydrochloride, Corynantheine, monohydrochloride, CORYNANTHEINE HYDROCHLORIDE [MI], CORYNANTHEINE HYDROCHLORIDE, (+)-, 17,18-Secoyohimban-16-carboxylic acid, 16,17,18,19-tetradehydro-17-methoxy-, methyl ester, (E)-, hydrochloride
| Molecular Formula | C22H27ClN2O3 |
|---|---|
| Molecular Weight | 402.17 g/mol |
| LogP | 4.0143 |
| Topological Polar Surface Area | 54.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.17102 |
| Heavy Atoms | 28 |
| Complexity | 904.319 |
Chemical Identifiers
| CAS Number | 5986-06-1 |
|---|---|
| SMILES | CO/C=C(\[C@H]1C[C@H]2C3=C(CCN2C[C@@H]1C=C)C4=CC=CC=C4N3)/C(=O)OC.Cl |
Product Overview
Corynantheine hydrochloride (CAS 5986-06-1), with molecular formula C22H27ClN2O3 and molecular weight 402.17 g/mol. IUPAC: methyl (E)-2-[(2S,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate;hydrochloride.
Chemical Property Profile of Corynantheine hydrochloride
Property Insights of Corynantheine hydrochloride
The XLogP value of 4.0143 indicates that Corynantheine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.56 Ų, Corynantheine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Corynantheine hydrochloride has 1 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 Corynantheine hydrochloride?
The CAS number of Corynantheine hydrochloride is 5986-06-1.
What is the molecular formula of Corynantheine hydrochloride?
The molecular formula of Corynantheine hydrochloride is C22H27ClN2O3.
What is the molecular weight of Corynantheine hydrochloride?
The molecular weight of Corynantheine hydrochloride is 402.17 g/mol.
Where can I buy Corynantheine hydrochloride?
You can request a quote for Corynantheine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Corynantheine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Corynantheine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.