![N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine structure](/static/products/893/893687-01-9.png)
N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine
TL;DR: N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine (CAS 893687-01-9) is a chemical compound with molecular formula C25H32F3NO3 and molecular weight 451.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine
Also Known As: N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine, (3,4-dimethoxybenzyl)-{2-[2,2-dimethyl-4-(3-trifluoromethylphenyl) tetrahydropyran-4-yl]ethyl}amine, [(3,4-DIMETHOXYPHENYL)METHYL](2-{2,2-DIMETHYL-4-[3-(TRIFLUOROMETHYL)PHENYL]OXAN-4-YL}ETHYL)AMINE, N-(3,4-dimethoxybenzyl)-2-(2,2-dimethyl-4-(3-(trifluoromethyl)phenyl)tetrahydro-2H-pyran-4-yl)ethanamine, N-(3,4-dimethoxybenzyl)-2-{2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-yl}ethanamine
| Molecular Formula | C25H32F3NO3 |
|---|---|
| Molecular Weight | 451.23 g/mol |
| LogP | 5.7293 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 451.23343 |
| Heavy Atoms | 32 |
| Complexity | 913.5454 |
Chemical Identifiers
| CAS Number | 893687-01-9 |
|---|---|
| SMILES | CC1(CC(CCO1)(CCNCC2=CC(=C(C=C2)OC)OC)C3=CC(=CC=C3)C(F)(F)F)C |
Product Overview
N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine (CAS 893687-01-9), with molecular formula C25H32F3NO3 and molecular weight 451.23 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine.
Chemical Property Profile of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine
Property Insights of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine
The XLogP value of 5.7293 indicates that N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine?
The CAS number of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine is 893687-01-9.
What is the molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine?
The molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine is C25H32F3NO3.
What is the molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine?
The molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine is 451.23 g/mol.
Where can I buy N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine?
You can request a quote for N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-dimethoxyphenyl)methyl]-2-[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.