N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate
TL;DR: N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate (CAS 58044-99-8) is a chemical compound with molecular formula C20H25N3O4 and molecular weight 371.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-benzyl-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine;(Z)-but-2-enedioic acid
Also Known As: tripelennamine, EINECS 261-079-7, 1H-Pyrrole,1-ethenyl-3-ethyl-2-phenyl, N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate, benzyl-[2-(dimethylazaniumyl)ethyl]-pyridin-2-ylazanium,but-2-enedioate
| Molecular Formula | C20H25N3O4 |
|---|---|
| Molecular Weight | 371.18 g/mol |
| LogP | 2.3616 |
| Topological Polar Surface Area | 93.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 371.1845 |
| Heavy Atoms | 27 |
| Complexity | 702.52136 |
Chemical Identifiers
| CAS Number | 58044-99-8 |
|---|---|
| SMILES | CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O |
Product Overview
N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate (CAS 58044-99-8), with molecular formula C20H25N3O4 and molecular weight 371.18 g/mol. IUPAC: N'-benzyl-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine;(Z)-but-2-enedioic acid.
Chemical Property Profile of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate
Property Insights of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate
The XLogP value of 2.3616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate. The TPSA of 93.97 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate. Following Lipinski's Rule of Five, N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate has 2 hydrogen bond donor(s) and 5 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 N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate?
The CAS number of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate is 58044-99-8.
What is the molecular formula of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate?
The molecular formula of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate is C20H25N3O4.
What is the molecular weight of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate?
The molecular weight of N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate is 371.18 g/mol.
Where can I buy N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate?
You can request a quote for N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate?
Yes, KEHONG BIO provides custom synthesis services for N'-Benzyl-N,N-dimethyl-N'-pyridin-2-ylethylenediammonium maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.