Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride
TL;DR: Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride (CAS 58497-03-3) is a chemical compound with molecular formula C12H17Cl3N2 and molecular weight 294.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dichlorophenyl)-1-(ethylamino)ethylidene]-ethylazanium chloride
Also Known As: Ethanimidamide, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, hydrochloride, 2-(3,4-Dichlorophenyl)-N,N'-diethylacetamidine hydrochloride, N,N'-Diethyl-2-(3,4-dichlorophenyl)ethanimidamide hydrochloride, ACETAMIDINE, 2-(3,4-DICHLOROPHENYL)-N,N'-DIETHYL-, MONOHYDROCHLORIDE, [2-(3,4-dichlorophenyl)-1-(ethylamino)ethylidene]-ethylazanium chloride
| Molecular Formula | C12H17Cl3N2 |
|---|---|
| Molecular Weight | 294.05 g/mol |
| LogP | -1.35 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.04575 |
| Heavy Atoms | 17 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 58497-03-3 |
|---|---|
| SMILES | CCNC(=[NH+]CC)CC1=CC(=C(C=C1)Cl)Cl.[Cl-] |
| InChIKey | PAVPURABCCEXIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride (CAS 58497-03-3), with molecular formula C12H17Cl3N2 and molecular weight 294.05 g/mol. IUPAC: [2-(3,4-dichlorophenyl)-1-(ethylamino)ethylidene]-ethylazanium chloride.
Chemical Property Profile of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride
Property Insights of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride
The XLogP value of -1.35 indicates that Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.0 Ų, Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride has 2 hydrogen bond donor(s) and 1 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 Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride?
The CAS number of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride is 58497-03-3.
What is the molecular formula of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride?
The molecular formula of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride is C12H17Cl3N2.
What is the molecular weight of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride?
The molecular weight of Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride is 294.05 g/mol.
Where can I buy Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride?
You can request a quote for Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Acetamidine, 2-(3,4-dichlorophenyl)-N,N'-diethyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.