![[2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium structure](/static/products/6743/6743-09-5.webp)
[2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium
TL;DR: [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium (CAS 6743-09-5) is a chemical compound with molecular formula C19H22BrN2O2+ and molecular weight 389.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium
Also Known As: N-Acetyl Adenine, N9-Acetyl Adenine, [2-(2-benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium, 2-(2-Benzoyl-4-bromoanilino)-N,N-diethyl-2-oxoethan-1-aminium
| Molecular Formula | C19H22BrN2O2+ |
|---|---|
| Molecular Weight | 389.09 g/mol |
| LogP | 2.5433 |
| Topological Polar Surface Area | 50.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.08646 |
| Heavy Atoms | 24 |
| Complexity | 712.56165 |
Chemical Identifiers
| CAS Number | 6743-09-5 |
|---|---|
| SMILES | CC[NH+](CC)CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2 |
Product Overview
[2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium (CAS 6743-09-5), with molecular formula C19H22BrN2O2+ and molecular weight 389.09 g/mol. IUPAC: [2-(2-benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium.
Chemical Property Profile of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium
Property Insights of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium
The XLogP value of 2.5433 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium. With a topological polar surface area (TPSA) of 50.61 Ų, [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium has 2 hydrogen bond donor(s) and 2 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 [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium?
The CAS number of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium is 6743-09-5.
What is the molecular formula of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium?
The molecular formula of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium is C19H22BrN2O2+.
What is the molecular weight of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium?
The molecular weight of [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium is 389.09 g/mol.
Where can I buy [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium?
You can request a quote for [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium?
Yes, KEHONG BIO provides custom synthesis services for [2-(2-Benzoyl-4-bromoanilino)-2-oxoethyl]-diethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.