Isorhyncophylline
TL;DR: Isorhyncophylline (CAS 39032-62-7) is a chemical compound with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl)-3-methoxyprop-2-enoate
Also Known As: Rhynchophylline, Corynoxine, Isorhynchophylline, Isorhyncophylline, Corynoxine B
| Molecular Formula | C22H28N2O4 |
|---|---|
| Molecular Weight | 384.20 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.2049 |
| Heavy Atoms | 28 |
| Complexity | 663.0 |
Chemical Identifiers
| CAS Number | 39032-62-7 |
|---|---|
| SMILES | CCC1CN2CCC3(C2CC1C(=COC)C(=O)OC)C4=CC=CC=C4NC3=O |
| InChIKey | DAXYUDFNWXHGBE-UHFFFAOYSA-N |
Product Overview
Isorhyncophylline (CAS 39032-62-7), with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol. IUPAC: methyl 2-(6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl)-3-methoxyprop-2-enoate.
Chemical Property Profile of Isorhyncophylline
Property Insights of Isorhyncophylline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isorhyncophylline. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Isorhyncophylline. Following Lipinski's Rule of Five, Isorhyncophylline 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 Isorhyncophylline?
The CAS number of Isorhyncophylline is 39032-62-7.
What is the molecular formula of Isorhyncophylline?
The molecular formula of Isorhyncophylline is C22H28N2O4.
What is the molecular weight of Isorhyncophylline?
The molecular weight of Isorhyncophylline is 384.20 g/mol.
Where can I buy Isorhyncophylline?
You can request a quote for Isorhyncophylline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isorhyncophylline?
Yes, KEHONG BIO provides custom synthesis services for Isorhyncophylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.