RefChem:551649
TL;DR: RefChem:551649 (CAS 65916-13-4) is a chemical compound with molecular formula C21H25BrN6O6 and molecular weight 536.10 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]-5-(hexan-2-ylamino)-4-methoxyphenyl]acetamide
Also Known As: 5-Acetamido-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxy-N-(1-methylpentyl)aniline, N-[2-[ azo]-4-methoxy-5-[ amino]phenyl]acetamide, Acetamide, N-(2-((2-bromo-4,6-dinitrophenyl)azo)-4-methoxy-5-((1-methylpentyl)amino)phenyl)-, Acetamide, N-(2-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-4-methoxy-5-((1-methylpentyl)amino)phenyl)-, N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-5-(hexan-2-ylamino)-4-methoxyphenyl]acetamide
| Molecular Formula | C21H25BrN6O6 |
|---|---|
| Molecular Weight | 536.10 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 536.1019 |
| Heavy Atoms | 34 |
| Complexity | 732.0 |
Chemical Identifiers
| CAS Number | 65916-13-4 |
|---|---|
| SMILES | CCCCC(C)NC1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC |
| InChIKey | XDLFAHVQHIYZDC-UHFFFAOYSA-N |
Product Overview
RefChem:551649 (CAS 65916-13-4), with molecular formula C21H25BrN6O6 and molecular weight 536.10 g/mol. IUPAC: N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-5-(hexan-2-ylamino)-4-methoxyphenyl]acetamide.
Chemical Property Profile of RefChem:551649
Property Insights of RefChem:551649
The XLogP value of 5.4 indicates that RefChem:551649 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:551649 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:551649 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:551649?
The CAS number of RefChem:551649 is 65916-13-4.
What is the molecular formula of RefChem:551649?
The molecular formula of RefChem:551649 is C21H25BrN6O6.
What is the molecular weight of RefChem:551649?
The molecular weight of RefChem:551649 is 536.10 g/mol.
Where can I buy RefChem:551649?
You can request a quote for RefChem:551649 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:551649?
Yes, KEHONG BIO provides custom synthesis services for RefChem:551649 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.