![4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate structure](/static/products/1263/126318-08-9.webp)
4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate
TL;DR: 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate (CAS 126318-08-9) is a chemical compound with molecular formula C23H31NO3 and molecular weight 369.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-(2,2-dimethyl-4-phenyloxan-4-yl)ethylamino]methyl]-2-methoxyphenol
Also Known As: BAS 00297077, AB00075968-01, 4-[[2-(2,2-dimethyl-4-phenyloxan-4-yl)ethylamino]methyl]-2-methoxyphenol, 4-(((2-(2,2-dimethyl-4-phenyltetrahydro-2H-pyran-4-yl)ethyl)amino)methyl)-2-methoxyphenol, 4-({[2-(2,2-dimethyl-4-phenyltetrahydro-2H-pyran-4-yl)ethyl]amino}methyl)-2-methoxyphenol
| Molecular Formula | C23H31NO3 |
|---|---|
| Molecular Weight | 369.23 g/mol |
| LogP | 4.4075 |
| Topological Polar Surface Area | 50.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 369.2304 |
| Heavy Atoms | 27 |
| Complexity | 744.54364 |
Chemical Identifiers
| CAS Number | 126318-08-9 |
|---|---|
| SMILES | CC1(CC(CCO1)(CCNCC2=CC(=C(C=C2)O)OC)C3=CC=CC=C3)C |
Product Overview
4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate (CAS 126318-08-9), with molecular formula C23H31NO3 and molecular weight 369.23 g/mol. IUPAC: 4-[[2-(2,2-dimethyl-4-phenyloxan-4-yl)ethylamino]methyl]-2-methoxyphenol.
Chemical Property Profile of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate
Property Insights of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate
The XLogP value of 4.4075 indicates that 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.72 Ų, 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate has 2 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 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate?
The CAS number of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate is 126318-08-9.
What is the molecular formula of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate?
The molecular formula of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate is C23H31NO3.
What is the molecular weight of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate?
The molecular weight of 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate is 369.23 g/mol.
Where can I buy 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate?
You can request a quote for 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate?
Yes, KEHONG BIO provides custom synthesis services for 4-[[2-(2,2-Dimethyl-4-phenyloxan-4-yl)ethylazaniumyl]methyl]-2-methoxyphenolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.