Cinosulfuron
TL;DR: Cinosulfuron (CAS 94593-91-6) is a chemical compound with molecular formula C15H19N5O7S and molecular weight 413.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[2-(2-methoxyethoxy)phenyl]sulfonylurea
Also Known As: Cinosulfuron, Cinosulfuron [ISO], SETOFF, CGA 142464, O659
| Molecular Formula | C15H19N5O7S |
|---|---|
| Molecular Weight | 413.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 413.10052 |
| Heavy Atoms | 28 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 94593-91-6 |
|---|---|
| SMILES | COCCOC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OC)OC |
| InChIKey | WMLPCIHUFDKWJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cinosulfuron (CAS 94593-91-6), with molecular formula C15H19N5O7S and molecular weight 413.10 g/mol. IUPAC: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[2-(2-methoxyethoxy)phenyl]sulfonylurea.
Chemical Property Profile of Cinosulfuron
Property Insights of Cinosulfuron
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinosulfuron. The TPSA of 159.0 Ų indicates high polarity, suggesting Cinosulfuron may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cinosulfuron has 2 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 Cinosulfuron?
The CAS number of Cinosulfuron is 94593-91-6.
What is the molecular formula of Cinosulfuron?
The molecular formula of Cinosulfuron is C15H19N5O7S.
What is the molecular weight of Cinosulfuron?
The molecular weight of Cinosulfuron is 413.10 g/mol.
Where can I buy Cinosulfuron?
You can request a quote for Cinosulfuron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinosulfuron?
Yes, KEHONG BIO provides custom synthesis services for Cinosulfuron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.