N-(3,4,5-trimethoxybenzyl)aniline
TL;DR: N-(3,4,5-trimethoxybenzyl)aniline (CAS 161957-95-5) is a chemical compound with molecular formula C16H19NO3 and molecular weight 273.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3,4,5-trimethoxyphenyl)methyl]aniline
Also Known As: N-(3,4,5-trimethoxybenzyl)aniline, starbld0035933, TimTec1_002660, N-[(3,4,5-trimethoxyphenyl)methyl]aniline, N-phenyl-(3,4,5-trimethoxybenzyl)amine
Technical Specifications
| Molecular Formula | C16H19NO3 |
| Molecular Weight | 273.1365 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 39.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.1365 Da |
| Heavy Atoms | 20 |
| Complexity | 254.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)CNC2=CC=CC=C2 |
| InChIKey | NLDFNAUENSDHOT-UHFFFAOYSA-N |
Chemical Property Profile of N-(3,4,5-trimethoxybenzyl)aniline
Property Insights of N-(3,4,5-trimethoxybenzyl)aniline
The XLogP value of 3.3 indicates that 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, N-(3,4,5-trimethoxybenzyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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 N-(3,4,5-trimethoxybenzyl)aniline?
The CAS number of N-(3,4,5-trimethoxybenzyl)aniline is 161957-95-5.
What is the molecular formula of N-(3,4,5-trimethoxybenzyl)aniline?
The molecular formula of N-(3,4,5-trimethoxybenzyl)aniline is C16H19NO3.
What is the molecular weight of N-(3,4,5-trimethoxybenzyl)aniline?
The molecular weight of N-(3,4,5-trimethoxybenzyl)aniline is 273.1365 g/mol.
Where can I buy N-(3,4,5-trimethoxybenzyl)aniline?
You can request a quote for 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 N-(3,4,5-trimethoxybenzyl)aniline?
Yes, CoreyChem provides custom synthesis services for N-(3,4,5-trimethoxybenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.