RefChem:551651
TL;DR: RefChem:551651 (CAS 53950-28-0) is a chemical compound with molecular formula C16H15BrN6O6 and molecular weight 466.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-4-methoxy-5-(methylamino)phenyl]acetamide
Also Known As: N-[2-[ azo]-4-methoxy-5- phenyl]acetamide, Acetamide, N-[2-[(2-bromo-4,6-dinitrophenyl)azo]-4-methoxy-5-(methylamino)phenyl]-, Acetamide, N-(2-((2-bromo-4,6-dinitrophenyl)azo)-4-methoxy-5-(methylamino)phenyl)-, Acetamide, N-(2-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-4-methoxy-5-(methylamino)phenyl)-, N-[2-[(2-Bromo-4,6-dinitrophenyl)azo]-4-methoxy-5-(methylamino)phenyl]acetamide
| Molecular Formula | C16H15BrN6O6 |
|---|---|
| Molecular Weight | 466.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.02365 |
| Heavy Atoms | 29 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 53950-28-0 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NC |
| InChIKey | QBILVGKVVDFNJB-UHFFFAOYSA-N |
Product Overview
RefChem:551651 (CAS 53950-28-0), with molecular formula C16H15BrN6O6 and molecular weight 466.02 g/mol. IUPAC: N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-4-methoxy-5-(methylamino)phenyl]acetamide.
Chemical Property Profile of RefChem:551651
Property Insights of RefChem:551651
The XLogP value of 3.2 indicates that RefChem:551651 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:551651 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:551651 has 2 hydrogen bond donor(s) and 9 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 RefChem:551651?
The CAS number of RefChem:551651 is 53950-28-0.
What is the molecular formula of RefChem:551651?
The molecular formula of RefChem:551651 is C16H15BrN6O6.
What is the molecular weight of RefChem:551651?
The molecular weight of RefChem:551651 is 466.02 g/mol.
Where can I buy RefChem:551651?
You can request a quote for RefChem:551651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:551651?
Yes, KEHONG BIO provides custom synthesis services for RefChem:551651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.