Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-
TL;DR: Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- (CAS 37744-86-8) is a chemical compound with molecular formula C17H18BrN5O5 and molecular weight 451.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-[2-bromoethyl(ethyl)amino]anilino]-2,4-dinitrobenzamide
Also Known As: N-Methyl-2-(4-aminophenyl)ethylamine, Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-, 5-(p-((2-Bromoethyl)ethylamino)anilino)-2,4-dinitrobenzamide, 5-[4-[2-bromoethyl(ethyl)amino]anilino]-2,4-dinitrobenzamide, 5-({4-[(2-bromoethyl)(ethyl)amino]phenyl}amino)-2,4-dinitrobenzamide
| Molecular Formula | C17H18BrN5O5 |
|---|---|
| Molecular Weight | 451.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 451.04913 |
| Heavy Atoms | 28 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 37744-86-8 |
|---|---|
| SMILES | CCN(CCBr)C1=CC=C(C=C1)NC2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | BBXHORAXORVJKX-UHFFFAOYSA-N |
Product Overview
Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- (CAS 37744-86-8), with molecular formula C17H18BrN5O5 and molecular weight 451.05 g/mol. IUPAC: 5-[4-[2-bromoethyl(ethyl)amino]anilino]-2,4-dinitrobenzamide.
Chemical Property Profile of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-
Property Insights of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-
The XLogP value of 3.8 indicates that Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- 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 Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-?
The CAS number of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- is 37744-86-8.
What is the molecular formula of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-?
The molecular formula of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- is C17H18BrN5O5.
What is the molecular weight of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-?
The molecular weight of Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- is 451.05 g/mol.
Where can I buy Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-?
You can request a quote for Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, 5-(p-((2-bromoethyl)ethylamino)anilino)-2,4-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.