2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine
TL;DR: 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine (CAS 355397-00-1) is a chemical compound with molecular formula C19H23NO5 and molecular weight 345.16 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-[(3,4,5-trimethoxyphenyl)methyl]ethanamine
Also Known As: BAS 01840827, AB00088674-01, 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine, 2-(1,3-benzodioxol-5-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine, (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4,5-trimethoxy-benzyl)-amine
| Molecular Formula | C19H23NO5 |
|---|---|
| Molecular Weight | 345.16 g/mol |
| LogP | 2.7734 |
| Topological Polar Surface Area | 58.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 345.15762 |
| Heavy Atoms | 25 |
| Complexity | 706.7446 |
Chemical Identifiers
| CAS Number | 355397-00-1 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CNCCC2=CC3=C(C=C2)OCO3 |
Product Overview
2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine (CAS 355397-00-1), with molecular formula C19H23NO5 and molecular weight 345.16 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine.
Chemical Property Profile of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine
Property Insights of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine
The XLogP value of 2.7734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine. With a topological polar surface area (TPSA) of 58.18 Ų, 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine has 1 hydrogen bond donor(s) and 6 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-(3,4,5-trimethoxybenzyl)ethanamine?
The CAS number of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine is 355397-00-1.
What is the molecular formula of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine?
The molecular formula of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine is C19H23NO5.
What is the molecular weight of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine?
The molecular weight of 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine is 345.16 g/mol.
Where can I buy 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine?
You can request a quote for 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)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-(3,4,5-trimethoxybenzyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzodioxol-5-yl)-N-(3,4,5-trimethoxybenzyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.