3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline
TL;DR: 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline (CAS 355395-70-9) is a chemical compound with molecular formula C17H21NO3 and molecular weight 287.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline
Also Known As: BIM-0020213.P001, 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline, 3-methyl-N-(3,4,5-trimethoxybenzyl)aniline, (3-methylphenyl)[(3,4,5-trimethoxyphenyl)methyl]amine, N-(3-METHYLPHENYL)-N-(3,4,5-TRIMETHOXYBENZYL)AMINE
| Molecular Formula | C17H21NO3 |
|---|---|
| Molecular Weight | 287.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 39.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.15213 |
| Heavy Atoms | 21 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 355395-70-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NCC2=CC(=C(C(=C2)OC)OC)OC |
| InChIKey | IAWAXHWOQZHPHB-UHFFFAOYSA-N |
Product Overview
3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline (CAS 355395-70-9), with molecular formula C17H21NO3 and molecular weight 287.15 g/mol. IUPAC: 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline.
Chemical Property Profile of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline
Property Insights of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline
The XLogP value of 3.7 indicates that 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]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, 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]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
Frequently Asked Questions
What is the CAS number of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline?
The CAS number of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline is 355395-70-9.
What is the molecular formula of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline?
The molecular formula of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline is C17H21NO3.
What is the molecular weight of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline?
The molecular weight of 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline is 287.15 g/mol.
Where can I buy 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline?
You can request a quote for 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.