NEURODYE RGA-30, PURE
TL;DR: NEURODYE RGA-30, PURE (CAS 335080-22-3) is a chemical compound with molecular formula C39H62N6O6S2 and molecular weight 774.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4E)-4-[(2E,4E)-5-(1,3-dibutyl-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-yl)penta-2,4-dienylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonate;bis(triethylazanium)
Also Known As: NEURODYE RGA-30, PURE, 4-[(4E)-4-[(2E,4E)-5-(1,3-Dibutyl-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-yl)penta-2,4-dienylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonate;triethylazanium, 4-[(4E)-4-[(2E,4E)-5-(1,3-dibutyl-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-yl)penta-2,4-dienylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonate; triethylazanium
| Molecular Formula | C39H62N6O6S2 |
|---|---|
| Molecular Weight | 774.42 g/mol |
| LogP | 3.73769 |
| Topological Polar Surface Area | 148.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 774.41724 |
| Heavy Atoms | 53 |
| Complexity | 1762.6265 |
Chemical Identifiers
| CAS Number | 335080-22-3 |
|---|---|
| SMILES | CCCCN1C(=C(C(=O)N(C1=S)CCCC)/C=C/C=C/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C)[O-].CC[NH+](CC)CC.CC[NH+](CC)CC |
Product Overview
NEURODYE RGA-30, PURE (CAS 335080-22-3), with molecular formula C39H62N6O6S2 and molecular weight 774.42 g/mol. IUPAC: 4-[(4E)-4-[(2E,4E)-5-(1,3-dibutyl-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-yl)penta-2,4-dienylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonate;bis(triethylazanium).
Chemical Property Profile of NEURODYE RGA-30, PURE
Property Insights of NEURODYE RGA-30, PURE
The XLogP value of 3.73769 indicates that NEURODYE RGA-30, PURE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.74 Ų indicates high polarity, suggesting NEURODYE RGA-30, PURE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NEURODYE RGA-30, PURE has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NEURODYE RGA-30, PURE?
The CAS number of NEURODYE RGA-30, PURE is 335080-22-3.
What is the molecular formula of NEURODYE RGA-30, PURE?
The molecular formula of NEURODYE RGA-30, PURE is C39H62N6O6S2.
What is the molecular weight of NEURODYE RGA-30, PURE?
The molecular weight of NEURODYE RGA-30, PURE is 774.42 g/mol.
Where can I buy NEURODYE RGA-30, PURE?
You can request a quote for NEURODYE RGA-30, PURE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NEURODYE RGA-30, PURE?
Yes, KEHONG BIO provides custom synthesis services for NEURODYE RGA-30, PURE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.