Elorine sulfate
TL;DR: Elorine sulfate (CAS 6138-33-6) is a chemical compound with molecular formula C20H33NO5S and molecular weight 399.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Elorine sulfate
1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenylpropan-1-ol;hydrogen sulfate
Also Known As: Elorine sulfate, TRICYCLAMOL SULFATE, Compound 14045 methsulfate, 1-Cyclohexyl-1-phenyl-3-pyrrolidino-1-propanol methsulfate, 1-(3-Cyclohexyl-3-hydroxy-3-phenylpropyl)-1-methyl-pyrrolidinium methyl sulfate
| Molecular Formula | C20H33NO5S |
|---|---|
| Molecular Weight | 399.21 g/mol |
| LogP | 3.09 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.20795 |
| Heavy Atoms | 27 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 6138-33-6 |
|---|---|
| SMILES | C[N+]1(CCCC1)CCC(C2CCCCC2)(C3=CC=CC=C3)O.OS(=O)(=O)[O-] |
| InChIKey | DPRNELZIOLXABV-UHFFFAOYSA-M |
Product Overview
Elorine sulfate (CAS 6138-33-6), with molecular formula C20H33NO5S and molecular weight 399.21 g/mol. IUPAC: 1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenylpropan-1-ol;hydrogen sulfate.
Chemical Property Profile of Elorine sulfate
Property Insights of Elorine sulfate
The XLogP value of 3.09 indicates that Elorine sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Elorine sulfate. Following Lipinski's Rule of Five, Elorine sulfate 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 Elorine sulfate?
The CAS number of Elorine sulfate is 6138-33-6.
What is the molecular formula of Elorine sulfate?
The molecular formula of Elorine sulfate is C20H33NO5S.
What is the molecular weight of Elorine sulfate?
The molecular weight of Elorine sulfate is 399.21 g/mol.
Where can I buy Elorine sulfate?
You can request a quote for Elorine sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Elorine sulfate?
Yes, KEHONG BIO provides custom synthesis services for Elorine sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.