5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine
TL;DR: 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine (CAS 893569-93-2) is a chemical compound with molecular formula C17H18BrNO and molecular weight 331.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-bromo-2-phenylmethoxyphenyl)methyl]prop-2-en-1-amine
Also Known As: 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine, N-{[2-(Benzyloxy)-5-bromophenyl]methyl}prop-2-en-1-amine, N-[(5-bromo-2-phenylmethoxy-phenyl)methyl]prop-2-en-1-amine, N-[(5-bromo-2-phenylmethoxyphenyl)methyl]prop-2-en-1-amine, {[2-(BENZYLOXY)-5-BROMOPHENYL]METHYL}(PROP-2-EN-1-YL)AMINE
| Molecular Formula | C17H18BrNO |
|---|---|
| Molecular Weight | 331.06 g/mol |
| LogP | 4.3037 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.0572 |
| Heavy Atoms | 20 |
| Complexity | 554.1714 |
Chemical Identifiers
| CAS Number | 893569-93-2 |
|---|---|
| SMILES | C=CCNCC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2 |
Product Overview
5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine (CAS 893569-93-2), with molecular formula C17H18BrNO and molecular weight 331.06 g/mol. IUPAC: N-[(5-bromo-2-phenylmethoxyphenyl)methyl]prop-2-en-1-amine.
Chemical Property Profile of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine
Property Insights of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine
The XLogP value of 4.3037 indicates that 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine has 1 hydrogen bond donor(s) and 2 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 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine?
The CAS number of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine is 893569-93-2.
What is the molecular formula of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine?
The molecular formula of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine is C17H18BrNO.
What is the molecular weight of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine?
The molecular weight of 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine is 331.06 g/mol.
Where can I buy 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine?
You can request a quote for 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-(phenylmethoxy)-N-2-propen-1-ylbenzenemethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.