RefChem:551746
TL;DR: RefChem:551746 (CAS 16421-40-2) is a chemical compound with molecular formula C26H25ClN6O8 and molecular weight 584.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
RefChem:551746
2-[5-acetamido-N-benzyl-4-[(2-chloro-4,6-dinitrophenyl)diazenyl]-2-methoxyanilino]ethyl acetate
Also Known As: Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[(2-chloro-4,6-dinitrophenyl)azo]-4-methoxyphenyl]-, 2-((5-Acetamide-4-((2-chloro-4,6-dinitrophenyl)azo)-2-methoxyphenyl)benzylamino)ethyl acetate, 2-[{5-(acetylamino)-4-[(e)-(2-chloro-4,6-dinitrophenyl)diazenyl]-2-methoxyphenyl}(benzyl)amino]ethyl acetate, Acetamide, N-(5-((2-(acetyloxy)ethyl)(phenylmethyl)amino)-2-((2-chloro-4,6-dinitrophenyl)azo)-4-methoxyphenyl)-, Acetamide, N-(5-((2-(acetyloxy)ethyl)(phenylmethyl)amino)-2-(2-(2-chloro-4,6-dinitrophenyl)diazenyl)-4-methoxyphenyl)-
| Molecular Formula | C26H25ClN6O8 |
|---|---|
| Molecular Weight | 584.14 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 584.1422 |
| Heavy Atoms | 41 |
| Complexity | 940.0 |
Chemical Identifiers
| CAS Number | 16421-40-2 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCOC(=O)C)CC3=CC=CC=C3 |
| InChIKey | DFAKODSMQXHLIH-UHFFFAOYSA-N |
Product Overview
RefChem:551746 (CAS 16421-40-2), with molecular formula C26H25ClN6O8 and molecular weight 584.14 g/mol. IUPAC: 2-[5-acetamido-N-benzyl-4-[(2-chloro-4,6-dinitrophenyl)diazenyl]-2-methoxyanilino]ethyl acetate.
Chemical Property Profile of RefChem:551746
Property Insights of RefChem:551746
The XLogP value of 4.6 indicates that RefChem:551746 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.0 Ų indicates high polarity, suggesting RefChem:551746 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:551746 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:551746?
The CAS number of RefChem:551746 is 16421-40-2.
What is the molecular formula of RefChem:551746?
The molecular formula of RefChem:551746 is C26H25ClN6O8.
What is the molecular weight of RefChem:551746?
The molecular weight of RefChem:551746 is 584.14 g/mol.
Where can I buy RefChem:551746?
You can request a quote for RefChem:551746 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:551746?
Yes, KEHONG BIO provides custom synthesis services for RefChem:551746 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.