O,O-Dimethylphyllostemine
TL;DR: O,O-Dimethylphyllostemine (CAS 126262-27-9) is a chemical compound with molecular formula C23H27NO3 and molecular weight 365.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8aR)-7-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)-1,2,3,5,8,8a-hexahydroindolizine
Also Known As: Secoantofine, O,O-Dimethylphyllostemine, (-)-13aalpha-Secoantofine, (-)-(R)-13aalpha-Secoantofine, J1.811.022I
| Molecular Formula | C23H27NO3 |
|---|---|
| Molecular Weight | 365.20 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 30.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.1991 |
| Heavy Atoms | 27 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 126262-27-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C[C@H]3CCCN3C2)C4=CC(=C(C=C4)OC)OC |
| InChIKey | WOAHFBLGXWXVSL-GOSISDBHSA-N |
Product Overview
O,O-Dimethylphyllostemine (CAS 126262-27-9), with molecular formula C23H27NO3 and molecular weight 365.20 g/mol. IUPAC: (8aR)-7-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)-1,2,3,5,8,8a-hexahydroindolizine.
Chemical Property Profile of O,O-Dimethylphyllostemine
Property Insights of O,O-Dimethylphyllostemine
The XLogP value of 3.8 indicates that O,O-Dimethylphyllostemine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.9 Ų, O,O-Dimethylphyllostemine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O,O-Dimethylphyllostemine has 0 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 O,O-Dimethylphyllostemine?
The CAS number of O,O-Dimethylphyllostemine is 126262-27-9.
What is the molecular formula of O,O-Dimethylphyllostemine?
The molecular formula of O,O-Dimethylphyllostemine is C23H27NO3.
What is the molecular weight of O,O-Dimethylphyllostemine?
The molecular weight of O,O-Dimethylphyllostemine is 365.20 g/mol.
Where can I buy O,O-Dimethylphyllostemine?
You can request a quote for O,O-Dimethylphyllostemine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-Dimethylphyllostemine?
Yes, KEHONG BIO provides custom synthesis services for O,O-Dimethylphyllostemine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.