N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide (CAS 428836-04-8) is a chemical compound with molecular formula C17H15ClN2O4 and molecular weight 346.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2-chlorophenyl)methyl]oxamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide, N1-(1,3-Benzodioxol-5-ylmethyl)-N2-[(2-chlorophenyl)methyl]ethanediamide, N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2-chlorophenyl)methyl]oxamide, N1-(benzo[d][1,3]dioxol-5-ylmethyl)-N2-(2-chlorobenzyl)oxalamide, N~1~-[(2H-1,3-Benzodioxol-5-yl)methyl]-N~2~-[(2-chlorophenyl)methyl]ethanediamide
| Molecular Formula | C17H15ClN2O4 |
|---|---|
| Molecular Weight | 346.07 g/mol |
| LogP | 2.0013 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.07202 |
| Heavy Atoms | 24 |
| Complexity | 778.9359 |
Chemical Identifiers
| CAS Number | 428836-04-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)C(=O)NCC3=CC=CC=C3Cl |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide (CAS 428836-04-8), with molecular formula C17H15ClN2O4 and molecular weight 346.07 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2-chlorophenyl)methyl]oxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide
The XLogP value of 2.0013 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide has 2 hydrogen bond donor(s) and 4 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 N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide is 428836-04-8.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide is C17H15ClN2O4.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide is 346.07 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-N'-(2-chlorobenzyl)ethanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.