![1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine structure](/static/products/880/880813-33-2.png)
1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine
TL;DR: 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine (CAS 880813-33-2) is a chemical compound with molecular formula C21H21BrN2O2 and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylmethanamine
Also Known As: AN-465/41673664, 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine, N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylmethanamine, (4-Benzyloxy-3-bromo-5-methoxy-benzyl)-pyridin-3-ylmethyl-amine, N-[4-(benzyloxy)-3-bromo-5-methoxybenzyl]-N-(3-pyridinylmethyl)amine
| Molecular Formula | C21H21BrN2O2 |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 4.7215 |
| Topological Polar Surface Area | 43.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.07864 |
| Heavy Atoms | 26 |
| Complexity | 826.17456 |
Chemical Identifiers
| CAS Number | 880813-33-2 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)CNCC2=CN=CC=C2)Br)OCC3=CC=CC=C3 |
Product Overview
1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine (CAS 880813-33-2), with molecular formula C21H21BrN2O2 and molecular weight 412.08 g/mol. IUPAC: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-pyridin-3-ylmethanamine.
Chemical Property Profile of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine
Property Insights of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine
The XLogP value of 4.7215 indicates that 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.38 Ų, 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine 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 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine?
The CAS number of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine is 880813-33-2.
What is the molecular formula of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine?
The molecular formula of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine is C21H21BrN2O2.
What is the molecular weight of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine?
The molecular weight of 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine is 412.08 g/mol.
Where can I buy 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine?
You can request a quote for 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-N-(pyridin-3-ylmethyl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.