N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine
TL;DR: N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine (CAS 65125-87-3) is a chemical compound with molecular formula C17H18ClN5O6 and molecular weight 423.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-chloro-4,6-dinitrophenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol
Also Known As: DIS. A. 8, N-(4-(2-CHLORO-4,6-DINITROPHENYLAZO)-3-METHYLPHENYL)DIETHANOLAMINE, J1.624.288H, 2-[4-[(2-chloro-4,6-dinitrophenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol, Ethanol,2,2'-[[4-[(2-chloro-4,6-dinitrophenyl)azo]-3-methylphenyl]imino]bis- (9CI)
| Molecular Formula | C17H18ClN5O6 |
|---|---|
| Molecular Weight | 423.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 423.09457 |
| Heavy Atoms | 29 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 65125-87-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KMLVKWGMGPTYLS-UHFFFAOYSA-N |
Product Overview
N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine (CAS 65125-87-3), with molecular formula C17H18ClN5O6 and molecular weight 423.09 g/mol. IUPAC: 2-[4-[(2-chloro-4,6-dinitrophenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol.
Chemical Property Profile of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine
Property Insights of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine
The XLogP value of 3.1 indicates that N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.0 Ų indicates high polarity, suggesting N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine 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 N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine?
The CAS number of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine is 65125-87-3.
What is the molecular formula of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine?
The molecular formula of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine is C17H18ClN5O6.
What is the molecular weight of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine?
The molecular weight of N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine is 423.09 g/mol.
Where can I buy N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine?
You can request a quote for N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(2-Chloro-4,6-dinitrophenylazo)-3-methylphenyl)diethanolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.