2-(N-benzylanilino)ethyl-dimethylazanium chloride
TL;DR: 2-(N-benzylanilino)ethyl-dimethylazanium chloride (CAS 2045-52-5) is a chemical compound with molecular formula C17H23ClN2 and molecular weight 290.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-benzylanilino)ethyl-dimethylazanium chloride
Also Known As: Antergan hydrochloride, Phenbenzamine chloride, Compound 2339 RP, Methyl 4-phenylbutyrate, Corps 2339 R P
| Molecular Formula | C17H23ClN2 |
|---|---|
| Molecular Weight | 290.15 g/mol |
| LogP | -1.16 |
| Topological Polar Surface Area | 7.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.15497 |
| Heavy Atoms | 20 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 2045-52-5 |
|---|---|
| SMILES | C[NH+](C)CCN(CC1=CC=CC=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | AJCNOWKYMZKMFV-UHFFFAOYSA-N |
Product Overview
2-(N-benzylanilino)ethyl-dimethylazanium chloride (CAS 2045-52-5), with molecular formula C17H23ClN2 and molecular weight 290.15 g/mol. IUPAC: 2-(N-benzylanilino)ethyl-dimethylazanium chloride.
Chemical Property Profile of 2-(N-benzylanilino)ethyl-dimethylazanium chloride
Property Insights of 2-(N-benzylanilino)ethyl-dimethylazanium chloride
The XLogP value of -1.16 indicates that 2-(N-benzylanilino)ethyl-dimethylazanium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 7.7 Ų, 2-(N-benzylanilino)ethyl-dimethylazanium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(N-benzylanilino)ethyl-dimethylazanium chloride 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-(N-benzylanilino)ethyl-dimethylazanium chloride?
The CAS number of 2-(N-benzylanilino)ethyl-dimethylazanium chloride is 2045-52-5.
What is the molecular formula of 2-(N-benzylanilino)ethyl-dimethylazanium chloride?
The molecular formula of 2-(N-benzylanilino)ethyl-dimethylazanium chloride is C17H23ClN2.
What is the molecular weight of 2-(N-benzylanilino)ethyl-dimethylazanium chloride?
The molecular weight of 2-(N-benzylanilino)ethyl-dimethylazanium chloride is 290.15 g/mol.
Where can I buy 2-(N-benzylanilino)ethyl-dimethylazanium chloride?
You can request a quote for 2-(N-benzylanilino)ethyl-dimethylazanium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-benzylanilino)ethyl-dimethylazanium chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-benzylanilino)ethyl-dimethylazanium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.