N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine
TL;DR: N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine (CAS 861649-30-1) is a chemical compound with molecular formula C25H27F2NO and molecular weight 395.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]-3-(4-propan-2-yloxyphenyl)propan-1-amine
Also Known As: 3-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]-3-(4-propan-2-yloxyphenyl)propan-1-amine, N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine, N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-[4-(propan-2-yloxy)phenyl]propan-1-amine
| Molecular Formula | C25H27F2NO |
|---|---|
| Molecular Weight | 395.21 g/mol |
| LogP | 6.0638 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 395.2061 |
| Heavy Atoms | 29 |
| Complexity | 891.4567 |
Chemical Identifiers
| CAS Number | 861649-30-1 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(CCNCC2=CC=CC=C2F)C3=CC=C(C=C3)F |
Product Overview
N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine (CAS 861649-30-1), with molecular formula C25H27F2NO and molecular weight 395.21 g/mol. IUPAC: 3-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]-3-(4-propan-2-yloxyphenyl)propan-1-amine.
Chemical Property Profile of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine
Property Insights of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine
The XLogP value of 6.0638 indicates that N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine?
The CAS number of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine is 861649-30-1.
What is the molecular formula of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine?
The molecular formula of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine is C25H27F2NO.
What is the molecular weight of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine?
The molecular weight of N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine is 395.21 g/mol.
Where can I buy N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine?
You can request a quote for N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-fluorobenzyl)-3-(4-fluorophenyl)-3-(4-isopropoxyphenyl)propan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.