![4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium structure](/static/products/254/254451-42-8.png)
4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium
TL;DR: 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium (CAS 254451-42-8) is a chemical compound with molecular formula C49H71N7O8S2 and molecular weight 949.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate;tris(triethylazanium)
Also Known As: 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium
| Molecular Formula | C49H71N7O8S2 |
|---|---|
| Molecular Weight | 949.48 g/mol |
| LogP | 3.30142 |
| Topological Polar Surface Area | 201.27 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 17 |
| Exact Mass | 949.4805 |
| Heavy Atoms | 66 |
| Complexity | 2409.2568 |
Chemical Identifiers
| CAS Number | 254451-42-8 |
|---|---|
| SMILES | CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC1=NN(C(=C1/C=C/C(=C/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C)/C4=CC=CC=C4)[O-])C5=CC=C(C=C5)S(=O)(=O)[O-] |
Product Overview
4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium (CAS 254451-42-8), with molecular formula C49H71N7O8S2 and molecular weight 949.48 g/mol. IUPAC: 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate;tris(triethylazanium).
Chemical Property Profile of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium
Property Insights of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium
The XLogP value of 3.30142 indicates that 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 201.27 Ų indicates high polarity, suggesting 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium?
The CAS number of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium is 254451-42-8.
What is the molecular formula of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium?
The molecular formula of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium is C49H71N7O8S2.
What is the molecular weight of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium?
The molecular weight of 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium is 949.48 g/mol.
Where can I buy 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium?
You can request a quote for 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-methyl-4-[(1E,3Z,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]-3-phenylpenta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate; triethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.