Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate
TL;DR: Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate (CAS 38289-18-8) is a chemical compound with molecular formula C13H15ClN2O4 and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(pyrrolidin-1-ium-1-ylidenemethyl)-1H-indole perchlorate
Also Known As: AI3-51480, KST-1B3810, 1-(1H-Indol-3-yl)methylenepyrrolidinium perchlorate, 4-methyl-N-(4-methylbenzyl)benzamide, Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate
| Molecular Formula | C13H15ClN2O4 |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | -2.3629 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.07202 |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 38289-18-8 |
|---|---|
| SMILES | C1CC[N+](=CC2=CNC3=CC=CC=C32)C1.[O-]Cl(=O)(=O)=O |
| InChIKey | PHXWZOWOVSMWOY-UHFFFAOYSA-N |
Product Overview
Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate (CAS 38289-18-8), with molecular formula C13H15ClN2O4 and molecular weight 298.07 g/mol. IUPAC: 3-(pyrrolidin-1-ium-1-ylidenemethyl)-1H-indole perchlorate.
Chemical Property Profile of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate
Property Insights of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate
The XLogP value of -2.3629 indicates that Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate. Following Lipinski's Rule of Five, Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate has 1 hydrogen bond donor(s) and 4 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-(1H-indol-3-yl)methylene-, perchlorate?
The CAS number of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate is 38289-18-8.
What is the molecular formula of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate?
The molecular formula of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate is C13H15ClN2O4.
What is the molecular weight of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate?
The molecular weight of Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate is 298.07 g/mol.
Where can I buy Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate?
You can request a quote for Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidinium, 1-(1H-indol-3-yl)methylene-, perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.