Ethametsulfuron-methyl
TL;DR: Ethametsulfuron-methyl (CAS 97780-06-8) is a chemical compound with molecular formula C15H18N6O6S and molecular weight 410.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate
Also Known As: Ethametsulfuron-methyl, Ethametsulfuron methyl, Muster, Ethametsulfuron, Salsa
| Molecular Formula | C15H18N6O6S |
|---|---|
| Molecular Weight | 410.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.10086 |
| Heavy Atoms | 28 |
| Complexity | 641.0 |
Chemical Identifiers
| CAS Number | 97780-06-8 |
|---|---|
| SMILES | CCOC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)NC |
| InChIKey | ZINJLDJMHCUBIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethametsulfuron-methyl (CAS 97780-06-8), with molecular formula C15H18N6O6S and molecular weight 410.10 g/mol. IUPAC: methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate.
Chemical Property Profile of Ethametsulfuron-methyl
Property Insights of Ethametsulfuron-methyl
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethametsulfuron-methyl. The TPSA of 170.0 Ų indicates high polarity, suggesting Ethametsulfuron-methyl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethametsulfuron-methyl has 3 hydrogen bond donor(s) and 10 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 Ethametsulfuron-methyl?
The CAS number of Ethametsulfuron-methyl is 97780-06-8.
What is the molecular formula of Ethametsulfuron-methyl?
The molecular formula of Ethametsulfuron-methyl is C15H18N6O6S.
What is the molecular weight of Ethametsulfuron-methyl?
The molecular weight of Ethametsulfuron-methyl is 410.10 g/mol.
Where can I buy Ethametsulfuron-methyl?
You can request a quote for Ethametsulfuron-methyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethametsulfuron-methyl?
Yes, KEHONG BIO provides custom synthesis services for Ethametsulfuron-methyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.