3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine
TL;DR: 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine (CAS 5531-98-6) is a chemical compound with molecular formula C20H23NO2 and molecular weight 309.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenanthren-1-yl)-N,N-dimethylethanamine
Also Known As: Atherosperminine, Atherospermine, atherospermine hydrochloride, 2-(3,4-dimethoxyphenanthren-1-yl)-N,N-dimethylethanamine, HY-N7648
| Molecular Formula | C20H23NO2 |
|---|---|
| Molecular Weight | 309.17 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.17288 |
| Heavy Atoms | 23 |
| Complexity | 373.0 |
| Melting Point | 199 - 200 °C |
Chemical Identifiers
| CAS Number | 5531-98-6 |
|---|---|
| SMILES | CN(C)CCC1=CC(=C(C2=C1C=CC3=CC=CC=C32)OC)OC |
| InChIKey | UZZFAUDNCIFFPM-UHFFFAOYSA-N |
Product Overview
3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine (CAS 5531-98-6), with molecular formula C20H23NO2 and molecular weight 309.17 g/mol. IUPAC: 2-(3,4-dimethoxyphenanthren-1-yl)-N,N-dimethylethanamine.
Chemical Property Profile of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine
Property Insights of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine
The XLogP value of 4.7 indicates that 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine has 0 hydrogen bond donor(s) and 3 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 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine?
The CAS number of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine is 5531-98-6.
What is the molecular formula of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine?
The molecular formula of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine is C20H23NO2.
What is the molecular weight of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine?
The molecular weight of 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine is 309.17 g/mol.
Where can I buy 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine?
You can request a quote for 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dimethoxy-N,N-dimethyl-1-phenanthreneethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.