N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide
TL;DR: N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide (CAS 331712-77-7) is a chemical compound with molecular formula C17H17ClN2O4 and molecular weight 348.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N'-(4-chloro-2,5-dimethoxyphenyl)oxamide
Also Known As: N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide, N-benzyl-N'-(4-chloro-2,5-dimethoxyphenyl)oxamide, N-Benzyl-N/'-(4-chloro-2,5-dimethoxyphenyl)oxamide
| Molecular Formula | C17H17ClN2O4 |
|---|---|
| Molecular Weight | 348.09 g/mol |
| LogP | 2.6121 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.08768 |
| Heavy Atoms | 24 |
| Complexity | 734.8704 |
Chemical Identifiers
| CAS Number | 331712-77-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1NC(=O)C(=O)NCC2=CC=CC=C2)OC)Cl |
Product Overview
N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide (CAS 331712-77-7), with molecular formula C17H17ClN2O4 and molecular weight 348.09 g/mol. IUPAC: N-benzyl-N'-(4-chloro-2,5-dimethoxyphenyl)oxamide.
Chemical Property Profile of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide
Property Insights of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide
The XLogP value of 2.6121 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide. Following Lipinski's Rule of Five, N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)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~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide?
The CAS number of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide is 331712-77-7.
What is the molecular formula of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide?
The molecular formula of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide is C17H17ClN2O4.
What is the molecular weight of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide?
The molecular weight of N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide is 348.09 g/mol.
Where can I buy N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide?
You can request a quote for N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)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~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide?
Yes, KEHONG BIO provides custom synthesis services for N~1~-benzyl-N~2~-(4-chloro-2,5-dimethoxyphenyl)ethanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.