RefChem:339951
TL;DR: RefChem:339951 (CAS 79143-72-9) is a chemical compound with molecular formula C17H28ClN3O2 and molecular weight 341.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-2-oxoethyl)-diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium chloride
Also Known As: Ethanaminium, 2-amino-N,N-diethyl-2-oxo-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-, chloride, (2-amino-2-oxoethyl)-diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium chloride
| Molecular Formula | C17H28ClN3O2 |
|---|---|
| Molecular Weight | 341.19 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 341.187 |
| Heavy Atoms | 23 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 79143-72-9 |
|---|---|
| SMILES | CC[N+](CC)(CC(=O)N)CC(=O)NC1=C(C=C(C=C1C)C)C.[Cl-] |
| InChIKey | HHYQYVDTVGKRLX-UHFFFAOYSA-N |
Product Overview
RefChem:339951 (CAS 79143-72-9), with molecular formula C17H28ClN3O2 and molecular weight 341.19 g/mol. IUPAC: (2-amino-2-oxoethyl)-diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium chloride.
Chemical Property Profile of RefChem:339951
Property Insights of RefChem:339951
The XLogP value of -1.1 indicates that RefChem:339951 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:339951. Following Lipinski's Rule of Five, RefChem:339951 has 2 hydrogen bond donor(s) and 3 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 RefChem:339951?
The CAS number of RefChem:339951 is 79143-72-9.
What is the molecular formula of RefChem:339951?
The molecular formula of RefChem:339951 is C17H28ClN3O2.
What is the molecular weight of RefChem:339951?
The molecular weight of RefChem:339951 is 341.19 g/mol.
Where can I buy RefChem:339951?
You can request a quote for RefChem:339951 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339951?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339951 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.