Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide
TL;DR: Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide (CAS 7176-47-8) is a chemical compound with molecular formula C14H22BrN3O3 and molecular weight 359.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-methyl-[2-[(4-nitrobenzoyl)amino]ethyl]azanium bromide
Also Known As: Diethylmethyl(2-(p-nitrobenzamido)ethyl)ammonium bromide, Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide, diethyl-methyl-[2-[(4-nitrobenzoyl)amino]ethyl]azanium bromide, RefChem:319284
| Molecular Formula | C14H22BrN3O3 |
|---|---|
| Molecular Weight | 359.08 g/mol |
| LogP | -1.185 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.08444 |
| Heavy Atoms | 21 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 7176-47-8 |
|---|---|
| SMILES | CC[N+](C)(CC)CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-].[Br-] |
| InChIKey | HEZZHMPVOQHMMG-UHFFFAOYSA-N |
Product Overview
Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide (CAS 7176-47-8), with molecular formula C14H22BrN3O3 and molecular weight 359.08 g/mol. IUPAC: diethyl-methyl-[2-[(4-nitrobenzoyl)amino]ethyl]azanium bromide.
Chemical Property Profile of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide
Property Insights of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide
The XLogP value of -1.185 indicates that Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide. Following Lipinski's Rule of Five, Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide has 1 hydrogen bond donor(s) and 4 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 Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide?
The CAS number of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide is 7176-47-8.
What is the molecular formula of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide?
The molecular formula of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide is C14H22BrN3O3.
What is the molecular weight of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide?
The molecular weight of Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide is 359.08 g/mol.
Where can I buy Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide?
You can request a quote for Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, diethylmethyl(2-(p-nitrobenzamido)ethyl)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.