Disperse Brown 4
TL;DR: Disperse Brown 4 (CAS 17464-91-4) is a chemical compound with molecular formula C16H15BrCl2N4O4 and molecular weight 475.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-bromo-6-chloro-4-nitrophenyl)diazenyl]-3-chloro-N-(2-hydroxyethyl)anilino]ethanol
Also Known As: Disperse Brown 4, Disperse Brown 4, C.I. Disperse Brown 1:1, HY-D0517, Ethanol, 2,2'-[[4-[(2-bromo-6-chloro-4-nitrophenyl)azo]-3-chlorophenyl]imino]bis-
| Molecular Formula | C16H15BrCl2N4O4 |
|---|---|
| Molecular Weight | 475.97 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.96536 |
| Heavy Atoms | 27 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 17464-91-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1N(CCO)CCO)Cl)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Cl |
| InChIKey | WZYPIHOBHDXNJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Disperse Brown 4 (CAS 17464-91-4), with molecular formula C16H15BrCl2N4O4 and molecular weight 475.97 g/mol. IUPAC: 2-[4-[(2-bromo-6-chloro-4-nitrophenyl)diazenyl]-3-chloro-N-(2-hydroxyethyl)anilino]ethanol.
Chemical Property Profile of Disperse Brown 4
Property Insights of Disperse Brown 4
The XLogP value of 4.2 indicates that Disperse Brown 4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Disperse Brown 4. Following Lipinski's Rule of Five, Disperse Brown 4 has 2 hydrogen bond donor(s) and 7 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 Disperse Brown 4?
The CAS number of Disperse Brown 4 is 17464-91-4.
What is the molecular formula of Disperse Brown 4?
The molecular formula of Disperse Brown 4 is C16H15BrCl2N4O4.
What is the molecular weight of Disperse Brown 4?
The molecular weight of Disperse Brown 4 is 475.97 g/mol.
Where can I buy Disperse Brown 4?
You can request a quote for Disperse Brown 4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disperse Brown 4?
Yes, KEHONG BIO provides custom synthesis services for Disperse Brown 4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.