![1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride structure](/static/products/1053/105376-93-0.webp)
1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride
TL;DR: 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride (CAS 105376-93-0) is a chemical compound with molecular formula C24H43Cl2N3O3 and molecular weight 491.26816 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl-[2-[(3-hexoxyphenyl)carbamoyloxy]-3-pyrrolidin-1-ium-1-ylpropyl]azanium dichloride
Also Known As: 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride, CARBAMIC ACID, (3-(HEXYLOXY)PHENYL)-, 1-((DIETHYLAMINO)METHYL)-2-(1-PYRROLIDINYL, diethyl-[2-[(3-hexoxyphenyl)carbamoyloxy]-3-pyrrolidin-1-ium-1-ylpropyl]azanium dichloride, 1-[3-(Diethylazaniumyl)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidin-1-ium dichloride
Technical Specifications
| Molecular Formula | C24H43Cl2N3O3 |
| Molecular Weight | 491.26816 g/mol |
| XLogP | -3.83 |
| Topological Polar Surface Area (TPSA) | 56.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 491.26816 Da |
| Heavy Atoms | 32 |
| Complexity | 453.0 |
| SMILES | CCCCCCOC1=CC=CC(=C1)NC(=O)OC(C[NH+]2CCCC2)C[NH+](CC)CC.[Cl-].[Cl-] |
| InChIKey | RMPQRUDBGQRYTN-UHFFFAOYSA-N |
Chemical Property Profile of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride
Property Insights of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride
The XLogP value of -3.83 indicates that 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.4 Ų, 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride?
The CAS number of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride is 105376-93-0.
What is the molecular formula of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride?
The molecular formula of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride is C24H43Cl2N3O3.
What is the molecular weight of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride?
The molecular weight of 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride is 491.26816 g/mol.
Where can I buy 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride?
You can request a quote for 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride?
Yes, CoreyChem provides custom synthesis services for 1-[3-(diethylammonio)-2-({[3-(hexyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidinium dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.