Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate
TL;DR: Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate (CAS 22966-83-2) is a chemical compound with molecular formula C14H23ClN2O4 and molecular weight 318.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methyl-5-pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate
Also Known As: 1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea, 1-(2-Methyl-5-pyrrolidino-2,4-pentadienylidene)pyrrolidinium perchlorate, Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate, 1-(2-Methyl-5-pyrrolidin-1-ylpenta-2,4-dienylidene)pyrrolidin-1-iumperchlorate, S-2-((3-Aminopropyl)amino)ethyl hydrogen thiosulfate hydrochloride
| Molecular Formula | C14H23ClN2O4 |
|---|---|
| Molecular Weight | 318.13 g/mol |
| LogP | -2.34 |
| Topological Polar Surface Area | 80.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.13464 |
| Heavy Atoms | 21 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 22966-83-2 |
|---|---|
| SMILES | CC(=CC=CN1CCCC1)C=[N+]2CCCC2.[O-]Cl(=O)(=O)=O |
| InChIKey | WLCJLILAPNEMNQ-UHFFFAOYSA-M |
Product Overview
Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate (CAS 22966-83-2), with molecular formula C14H23ClN2O4 and molecular weight 318.13 g/mol. IUPAC: 1-(4-methyl-5-pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate.
Chemical Property Profile of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate
Property Insights of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate
The XLogP value of -2.34 indicates that Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate. Following Lipinski's Rule of Five, Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate has 0 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 Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate?
The CAS number of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate is 22966-83-2.
What is the molecular formula of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate?
The molecular formula of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate is C14H23ClN2O4.
What is the molecular weight of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate?
The molecular weight of Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate is 318.13 g/mol.
Where can I buy Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate?
You can request a quote for Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, 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-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidinium, 1-(2-methyl-5-pyrrolidino-2,4-pentadienylidene)-, perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.