4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline
TL;DR: 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline (CAS 151221-97-5) is a chemical compound with molecular formula C18H23NO3 and molecular weight 301.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline
Also Known As: 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline, 4-ethyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline, 4-Ethyl-N-(3,5-trimethoxybenzyl)aniline, NCI60_017683, NCI60_017684
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H23NO3 |
| Molecular Weight | 301.1678 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 39.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 301.1678 Da |
| Heavy Atoms | 22 |
| Complexity | 291.0 |
| SMILES | CCC1=CC=C(C=C1)NCC2=CC(=C(C(=C2)OC)OC)OC |
| InChIKey | PVGALIKOSLDYBA-UHFFFAOYSA-N |
Chemical Property Profile of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline
Property Insights of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline
The XLogP value of 4.1 indicates that 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.7 Ų, 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline?
The CAS number of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline is 151221-97-5.
What is the molecular formula of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline?
The molecular formula of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline is C18H23NO3.
What is the molecular weight of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline?
The molecular weight of 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline is 301.1678 g/mol.
Where can I buy 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline?
You can request a quote for 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline?
Yes, CoreyChem provides custom synthesis services for 4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.