Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)
TL;DR: Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) (CAS 2933-22-4) is a chemical compound with molecular formula C19H25BrN2 and molecular weight 360.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-N-phenylaniline bromide
Also Known As: C19H25N2.Br.1/4H2O, C19-H25-N2.Br.1/4H2-O, 1-(2-(Diphenylamino)ethyl)-1-methyl-pyrrolidinium bromide hydrate, Bromuro di N-metil-N-(beta-difenilaminoetil)pirrolidinio, Bromuro di N-metil-N-(beta-difenilaminoetil)pirrolidinio [Italian]
| Molecular Formula | C19H25BrN2 |
|---|---|
| Molecular Weight | 360.12 g/mol |
| LogP | 1.0691 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.12012 |
| Heavy Atoms | 22 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 2933-22-4 |
|---|---|
| SMILES | C[N+]1(CCCC1)CCN(C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
| InChIKey | KMRFJMNVGDKPFD-UHFFFAOYSA-M |
Product Overview
Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) (CAS 2933-22-4), with molecular formula C19H25BrN2 and molecular weight 360.12 g/mol. IUPAC: N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-N-phenylaniline bromide.
Chemical Property Profile of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)
Property Insights of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)
The XLogP value of 1.0691 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1). With a topological polar surface area (TPSA) of 3.2 Ų, Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) has 0 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 Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)?
The CAS number of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) is 2933-22-4.
What is the molecular formula of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)?
The molecular formula of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) is C19H25BrN2.
What is the molecular weight of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)?
The molecular weight of Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) is 360.12 g/mol.
Where can I buy Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)?
You can request a quote for Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1)?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidinium, 1-(2-(diphenylamino)ethyl)-1-methyl-, bromide, hydrate (4:4:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.