ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate
TL;DR: ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate (CAS 352318-71-9) is a chemical compound with molecular formula C19H22F3N5O7S and molecular weight 521.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-ethoxy-3,3,3-trifluoro-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamoylamino]propanoate
Also Known As: ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate, ethyl 2-ethoxy-3,3,3-trifluoro-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamoylamino]propanoate, ETHYL 2-ETHOXY-3,3,3-TRIFLUORO-2-[({4-[(6-METHOXYPYRIDAZIN-3-YL)SULFAMOYL]PHENYL}CARBAMOYL)AMINO]PROPANOATE, ethyl 2-ethoxy-3,3,3-trifluoro-2-{[(4-{[(6-methoxy-3-pyridazinyl)amino]sulfonyl}anilino)carbonyl]amino}propanoate, ethyl 2-ethoxy-3,3,3-trifluoro-2-{[N-(4-{[(6-methoxypyridazin-3-yl)amino]sulfo nyl}phenyl)carbamoyl]amino}propanoate
| Molecular Formula | C19H22F3N5O7S |
|---|---|
| Molecular Weight | 521.12 g/mol |
| LogP | 2.2657 |
| Topological Polar Surface Area | 157.84 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 521.1192 |
| Heavy Atoms | 35 |
| Complexity | 1129.0208 |
Chemical Identifiers
| CAS Number | 352318-71-9 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(C=C2)OC)OCC |
Product Overview
ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate (CAS 352318-71-9), with molecular formula C19H22F3N5O7S and molecular weight 521.12 g/mol. IUPAC: ethyl 2-ethoxy-3,3,3-trifluoro-2-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamoylamino]propanoate.
Chemical Property Profile of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate
Property Insights of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate
The XLogP value of 2.2657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate. The TPSA of 157.84 Ų indicates high polarity, suggesting ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate?
The CAS number of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate is 352318-71-9.
What is the molecular formula of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate?
The molecular formula of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate is C19H22F3N5O7S.
What is the molecular weight of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate?
The molecular weight of ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate is 521.12 g/mol.
Where can I buy ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate?
You can request a quote for ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-ethoxy-3,3,3-trifluoro-2-(3-(4-(N-(6-methoxypyridazin-3-yl)sulfamoyl)phenyl)ureido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.