Cuscohygrine bis(methyl benzenesulfonate)
TL;DR: Cuscohygrine bis(methyl benzenesulfonate) (CAS 62355-03-7) is a chemical compound with molecular formula C27H40N2O7S2 and molecular weight 568.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfonate;1,3-bis(1,1-dimethylpyrrolidin-1-ium-2-yl)propan-2-one
Also Known As: Cuscohygrine bis(methyl benzenesulfonate), 1,3-Bis(N,N-dimethyl-2-pyrrolidinium)propane dibenzenesulfonate, 2,2'-(2-Oxo-trimethylene)bis(1,1-dimethylpyrrolidinium) dibenzenesulfonate, Pyrrolidinium, 2,2'-(2-oxotrimethylene)bis(1,1-dimethyl-, dibenzenesulfonate, benzenesulfonate; 1,3-bis(1,1-dimethylpyrrolidin-1-ium-2-yl)propan-2-one
| Molecular Formula | C27H40N2O7S2 |
|---|---|
| Molecular Weight | 568.23 g/mol |
| LogP | 2.9947 |
| Topological Polar Surface Area | 131.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 568.2277 |
| Heavy Atoms | 38 |
| Complexity | 1149.3461 |
Chemical Identifiers
| CAS Number | 62355-03-7 |
|---|---|
| SMILES | C[N+]1(CCCC1CC(=O)CC2CCC[N+]2(C)C)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-] |
Product Overview
Cuscohygrine bis(methyl benzenesulfonate) (CAS 62355-03-7), with molecular formula C27H40N2O7S2 and molecular weight 568.23 g/mol. IUPAC: benzenesulfonate;1,3-bis(1,1-dimethylpyrrolidin-1-ium-2-yl)propan-2-one.
Chemical Property Profile of Cuscohygrine bis(methyl benzenesulfonate)
Property Insights of Cuscohygrine bis(methyl benzenesulfonate)
The XLogP value of 2.9947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cuscohygrine bis(methyl benzenesulfonate). The TPSA of 131.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Cuscohygrine bis(methyl benzenesulfonate). Following Lipinski's Rule of Five, Cuscohygrine bis(methyl benzenesulfonate) has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cuscohygrine bis(methyl benzenesulfonate)?
The CAS number of Cuscohygrine bis(methyl benzenesulfonate) is 62355-03-7.
What is the molecular formula of Cuscohygrine bis(methyl benzenesulfonate)?
The molecular formula of Cuscohygrine bis(methyl benzenesulfonate) is C27H40N2O7S2.
What is the molecular weight of Cuscohygrine bis(methyl benzenesulfonate)?
The molecular weight of Cuscohygrine bis(methyl benzenesulfonate) is 568.23 g/mol.
Where can I buy Cuscohygrine bis(methyl benzenesulfonate)?
You can request a quote for Cuscohygrine bis(methyl benzenesulfonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cuscohygrine bis(methyl benzenesulfonate)?
Yes, KEHONG BIO provides custom synthesis services for Cuscohygrine bis(methyl benzenesulfonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.