Trifloxysulfuron
TL;DR: Trifloxysulfuron (CAS 145099-21-4) is a chemical compound with molecular formula C14H14F3N5O6S and molecular weight 437.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethoxypyrimidin-2-yl)-3-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]sulfonyl]urea
Also Known As: Trifloxysulfuron, Trifloxysulfuron [ISO], EX-A4268, 1- -3-[3- -2-pyridylsulfonyl]urea, M988
| Molecular Formula | C14H14F3N5O6S |
|---|---|
| Molecular Weight | 437.06 g/mol |
| LogP | 1.3403 |
| Topological Polar Surface Area | 141.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 437.06168 |
| Heavy Atoms | 29 |
| Complexity | 963.69806 |
Chemical Identifiers
| CAS Number | 145099-21-4 |
|---|---|
| SMILES | COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=N2)OCC(F)(F)F)OC |
Product Overview
Trifloxysulfuron (CAS 145099-21-4), with molecular formula C14H14F3N5O6S and molecular weight 437.06 g/mol. IUPAC: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[[3-(2,2,2-trifluoroethoxy)-2-pyridinyl]sulfonyl]urea.
Chemical Property Profile of Trifloxysulfuron
Property Insights of Trifloxysulfuron
The XLogP value of 1.3403 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trifloxysulfuron. The TPSA of 141.63 Ų indicates high polarity, suggesting Trifloxysulfuron may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trifloxysulfuron has 2 hydrogen bond donor(s) and 9 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 Trifloxysulfuron?
The CAS number of Trifloxysulfuron is 145099-21-4.
What is the molecular formula of Trifloxysulfuron?
The molecular formula of Trifloxysulfuron is C14H14F3N5O6S.
What is the molecular weight of Trifloxysulfuron?
The molecular weight of Trifloxysulfuron is 437.06 g/mol.
Where can I buy Trifloxysulfuron?
You can request a quote for Trifloxysulfuron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trifloxysulfuron?
Yes, KEHONG BIO provides custom synthesis services for Trifloxysulfuron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.