N-Methyllaurotetanine
TL;DR: N-Methyllaurotetanine (CAS 2169-44-0) is a chemical compound with molecular formula C20H23NO4 and molecular weight 341.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-ol
Also Known As: Lauroscholtzine, N-Methyllaurotetanine, Rogersine, Boldine 2-methyl ether, Methyllaurotetanine
| Molecular Formula | C20H23NO4 |
|---|---|
| Molecular Weight | 341.16 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.16272 |
| Heavy Atoms | 25 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 2169-44-0 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)OC |
| InChIKey | ZFLRVRLYWHNAEC-AWEZNQCLSA-N |
Product Overview
N-Methyllaurotetanine (CAS 2169-44-0), with molecular formula C20H23NO4 and molecular weight 341.16 g/mol. IUPAC: (6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-ol.
Chemical Property Profile of N-Methyllaurotetanine
Property Insights of N-Methyllaurotetanine
The XLogP value of 3.0 indicates that N-Methyllaurotetanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, N-Methyllaurotetanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyllaurotetanine 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 N-Methyllaurotetanine?
The CAS number of N-Methyllaurotetanine is 2169-44-0.
What is the molecular formula of N-Methyllaurotetanine?
The molecular formula of N-Methyllaurotetanine is C20H23NO4.
What is the molecular weight of N-Methyllaurotetanine?
The molecular weight of N-Methyllaurotetanine is 341.16 g/mol.
Where can I buy N-Methyllaurotetanine?
You can request a quote for N-Methyllaurotetanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyllaurotetanine?
Yes, KEHONG BIO provides custom synthesis services for N-Methyllaurotetanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.