3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine
TL;DR: 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine (CAS 672887-00-2) is a chemical compound with molecular formula C24H24ClNO3 and molecular weight 409.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]-3-(2-methoxyphenyl)propan-1-amine
Also Known As: 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine, 3-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]-3-(2-methoxyphenyl)propan-1-amine, 3-(benzo[d][1,3]dioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine, 3-benzo[1,3]dioxol-5-yl-N-[(4-chlorophenyl)methyl]-3-(2-methoxyphenyl)propan-1-amine
| Molecular Formula | C24H24ClNO3 |
|---|---|
| Molecular Weight | 409.14 g/mol |
| LogP | 5.3891 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 409.14447 |
| Heavy Atoms | 29 |
| Complexity | 958.59454 |
Chemical Identifiers
| CAS Number | 672887-00-2 |
|---|---|
| SMILES | COC1=CC=CC=C1C(CCNCC2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)OCO4 |
Product Overview
3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine (CAS 672887-00-2), with molecular formula C24H24ClNO3 and molecular weight 409.14 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]-3-(2-methoxyphenyl)propan-1-amine.
Chemical Property Profile of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine
Property Insights of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine
The XLogP value of 5.3891 indicates that 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine?
The CAS number of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine is 672887-00-2.
What is the molecular formula of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine?
The molecular formula of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine is C24H24ClNO3.
What is the molecular weight of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine?
The molecular weight of 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine is 409.14 g/mol.
Where can I buy 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine?
You can request a quote for 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)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 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)-3-(2-methoxyphenyl)propan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.