2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)
TL;DR: 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) (CAS 73680-80-5) is a chemical compound with molecular formula C13H21IN2O and molecular weight 348.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-anilino-2-oxoethyl)-diethyl-methylazanium iodide
Also Known As: NIOSH/BP8074800, (Carbaniloylmethyl)diethylmethylammonium iodide, (Phenylcarbamoylmethyl)diethylmethyl ammonium iodide, Diethylmethyl(carbaniloylmethyl)ammonium iodide, Ammonium, diethylmethyl(carbaniloylmethyl)-, iodide
| Molecular Formula | C13H21IN2O |
|---|---|
| Molecular Weight | 348.07 g/mol |
| LogP | -0.88 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.06985 |
| Heavy Atoms | 17 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 73680-80-5 |
|---|---|
| SMILES | CC[N+](C)(CC)CC(=O)NC1=CC=CC=C1.[I-] |
| InChIKey | YAESJOGFFOZVRZ-UHFFFAOYSA-N |
Product Overview
2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) (CAS 73680-80-5), with molecular formula C13H21IN2O and molecular weight 348.07 g/mol. IUPAC: (2-anilino-2-oxoethyl)-diethyl-methylazanium iodide.
Chemical Property Profile of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)
Property Insights of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)
The XLogP value of -0.88 indicates that 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.1 Ų, 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) has 1 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-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)?
The CAS number of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) is 73680-80-5.
What is the molecular formula of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)?
The molecular formula of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) is C13H21IN2O.
What is the molecular weight of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)?
The molecular weight of 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) is 348.07 g/mol.
Where can I buy 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)?
You can request a quote for 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethyl(methyl)azaniumyl)-N-phenylethanimidate--hydrogen iodide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.