(1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide
TL;DR: (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide (CAS 497942-91-3) is a chemical compound with molecular formula C18H19N3O5 and molecular weight 357.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[1-amino-2-(4-nitrophenyl)ethylidene]amino] 2-(3,5-dimethylphenoxy)acetate
Also Known As: (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide, (Z)-N'-(2-(3,5-dimethylphenoxy)acetoxy)-2-(4-nitrophenyl)acetimidamide, [(Z)-[1-amino-2-(4-nitrophenyl)ethylidene]amino] 2-(3,5-dimethylphenoxy)acetate
| Molecular Formula | C18H19N3O5 |
|---|---|
| Molecular Weight | 357.13 g/mol |
| LogP | 2.64854 |
| Topological Polar Surface Area | 117.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.13248 |
| Heavy Atoms | 26 |
| Complexity | 810.9703 |
Chemical Identifiers
| CAS Number | 497942-91-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCC(=O)O/N=C(/CC2=CC=C(C=C2)[N+](=O)[O-])\N)C |
Product Overview
(1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide (CAS 497942-91-3), with molecular formula C18H19N3O5 and molecular weight 357.13 g/mol. IUPAC: [(Z)-[1-amino-2-(4-nitrophenyl)ethylidene]amino] 2-(3,5-dimethylphenoxy)acetate.
Chemical Property Profile of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide
Property Insights of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide
The XLogP value of 2.64854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide. The TPSA of 117.05 Ų falls within the moderate polarity range, balancing permeability and solubility for (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide. Following Lipinski's Rule of Five, (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide 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 (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide?
The CAS number of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide is 497942-91-3.
What is the molecular formula of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide?
The molecular formula of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide is C18H19N3O5.
What is the molecular weight of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide?
The molecular weight of (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide is 357.13 g/mol.
Where can I buy (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide?
You can request a quote for (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide?
Yes, KEHONG BIO provides custom synthesis services for (1Z)-N'-{[(3,5-dimethylphenoxy)acetyl]oxy}-2-(4-nitrophenyl)ethanimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.