1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine
TL;DR: 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine (CAS 1050075-78-9) is a chemical compound with molecular formula C16H21ClN2O3 and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyridin-4-yl-N-[(2,4,5-trimethoxyphenyl)methyl]methanamine;hydrochloride
Also Known As: 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine, 1-(Pyridin-4-yl)-N-(2,4,5-trimethoxybenzyl)methanamine hydrochloride, 1-pyridin-4-yl-N-[(2,4,5-trimethoxyphenyl)methyl]methanamine hydrochloride, N-(pyridin-4-ylmethyl)-1-(2,4,5-trimethoxyphenyl)methanamine Hydrochloride
| Molecular Formula | C16H21ClN2O3 |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 2.819 |
| Topological Polar Surface Area | 52.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 324.12408 |
| Heavy Atoms | 22 |
| Complexity | 579.10364 |
Chemical Identifiers
| CAS Number | 1050075-78-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1CNCC2=CC=NC=C2)OC)OC.Cl |
Product Overview
1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine (CAS 1050075-78-9), with molecular formula C16H21ClN2O3 and molecular weight 324.12 g/mol. IUPAC: 1-pyridin-4-yl-N-[(2,4,5-trimethoxyphenyl)methyl]methanamine;hydrochloride.
Chemical Property Profile of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine
Property Insights of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine
The XLogP value of 2.819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine. With a topological polar surface area (TPSA) of 52.61 Ų, 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine has 1 hydrogen bond donor(s) and 5 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 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine?
The CAS number of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine is 1050075-78-9.
What is the molecular formula of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine?
The molecular formula of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine is C16H21ClN2O3.
What is the molecular weight of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine?
The molecular weight of 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine is 324.12 g/mol.
Where can I buy 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine?
You can request a quote for 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-pyridin-4-yl-{N}-(2,4,5-trimethoxybenzyl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.