Methylpsychotrine
TL;DR: Methylpsychotrine (CAS 523-01-3) is a chemical compound with molecular formula C29H38N2O4 and molecular weight 478.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,11bS)-2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
Also Known As: O-Methylpsychotrine, Methylpsychotrine, Methylpsychotrin, 1',2'-Dehydroemetin, O-methyl-psychotrine
| Molecular Formula | C29H38N2O4 |
|---|---|
| Molecular Weight | 478.28 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 52.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.28317 |
| Heavy Atoms | 35 |
| Complexity | 731.0 |
Chemical Identifiers
| CAS Number | 523-01-3 |
|---|---|
| SMILES | CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1CC4=NCCC5=CC(=C(C=C54)OC)OC)OC)OC |
| InChIKey | FBRKYRSUSJWLHH-HMHJJOSWSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methylpsychotrine (CAS 523-01-3), with molecular formula C29H38N2O4 and molecular weight 478.28 g/mol. IUPAC: (2R,3R,11bS)-2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine.
Chemical Property Profile of Methylpsychotrine
Property Insights of Methylpsychotrine
The XLogP value of 4.6 indicates that Methylpsychotrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.5 Ų, Methylpsychotrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methylpsychotrine has 0 hydrogen bond donor(s) and 6 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 Methylpsychotrine?
The CAS number of Methylpsychotrine is 523-01-3.
What is the molecular formula of Methylpsychotrine?
The molecular formula of Methylpsychotrine is C29H38N2O4.
What is the molecular weight of Methylpsychotrine?
The molecular weight of Methylpsychotrine is 478.28 g/mol.
Where can I buy Methylpsychotrine?
You can request a quote for Methylpsychotrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylpsychotrine?
Yes, KEHONG BIO provides custom synthesis services for Methylpsychotrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.