![Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine structure](/static/products/880/880806-75-7.png)
Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine
TL;DR: Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine (CAS 880806-75-7) is a chemical compound with molecular formula C17H18ClNO4 and molecular weight 335.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-N-[(3-chloro-4,5-dimethoxyphenyl)methyl]methanamine
Also Known As: ASN 12416290, AN-465/42833964, Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine, N-(1,3-benzodioxol-5-ylmethyl)-N-(3-chloro-4,5-dimethoxybenzyl)amine, 1-(1,3-benzodioxol-5-yl)-N-[(3-chloro-4,5-dimethoxyphenyl)methyl]methanamine
| Molecular Formula | C17H18ClNO4 |
|---|---|
| Molecular Weight | 335.09 g/mol |
| LogP | 3.3757 |
| Topological Polar Surface Area | 48.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.09244 |
| Heavy Atoms | 23 |
| Complexity | 705.233 |
Chemical Identifiers
| CAS Number | 880806-75-7 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)CNCC2=CC3=C(C=C2)OCO3)Cl)OC |
Product Overview
Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine (CAS 880806-75-7), with molecular formula C17H18ClNO4 and molecular weight 335.09 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-N-[(3-chloro-4,5-dimethoxyphenyl)methyl]methanamine.
Chemical Property Profile of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine
Property Insights of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine
The XLogP value of 3.3757 indicates that Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.95 Ų, Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine has 1 hydrogen bond donor(s) and 5 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 Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine?
The CAS number of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine is 880806-75-7.
What is the molecular formula of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine?
The molecular formula of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine is C17H18ClNO4.
What is the molecular weight of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine?
The molecular weight of Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine is 335.09 g/mol.
Where can I buy Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine?
You can request a quote for Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine?
Yes, KEHONG BIO provides custom synthesis services for Benzo[1,3]dioxol-5-ylmethyl-(3-chloro-4,5-dimethoxy-benzyl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.