![2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine structure](/static/products/4237/423733-01-1.webp)
2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine
TL;DR: 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine (CAS 423733-01-1) is a chemical compound with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine
Also Known As: BAS 02500374, BIM-0038143.P001, 2-(1,3-benzodioxol-5-yl)-N-(4-chlorobenzyl)ethanamine, 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine, (2-Benzo[1,3]dioxol-5-yl-ethyl)-(4-chloro-benzyl)-amine
| Molecular Formula | C16H16ClNO2 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 3.401 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.08694 |
| Heavy Atoms | 20 |
| Complexity | 583.53076 |
Chemical Identifiers
| CAS Number | 423733-01-1 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CCNCC3=CC=C(C=C3)Cl |
Product Overview
2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine (CAS 423733-01-1), with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine.
Chemical Property Profile of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine
Property Insights of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine
The XLogP value of 3.401 indicates that 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine has 1 hydrogen bond donor(s) and 3 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 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine?
The CAS number of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine is 423733-01-1.
What is the molecular formula of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine?
The molecular formula of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine is C16H16ClNO2.
What is the molecular weight of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine?
The molecular weight of 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine is 289.09 g/mol.
Where can I buy 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine?
You can request a quote for 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzodioxol-5-yl)-N-[(4-chlorophenyl)methyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.