磺酰磺隆
TL;DR: 磺酰磺隆 (CAS 141776-32-1) is a chemical compound with molecular formula C16H18N6O7S2 and molecular weight 470.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磺酰磺隆
1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
Also Known As: Sulfosulfuron, maverick, outrider, ulfosulfuron, Sulfosulfuron [ISO]
| Molecular Formula | C16H18N6O7S2 |
|---|---|
| Molecular Weight | 470.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.06784 |
| Heavy Atoms | 31 |
| Complexity | 831.0 |
| Melting Point | 201.1 to 201.7 °C |
| Density | 1.5185 at 20 °C |
| Solubility | In acetone 0.71, methanol 0.33, ethyl acetate 1.01, dichloromethane 4.35, xylene 0.16, heptane <0.01 (all in g/L, 20 °C) |
| Vapor Pressure | VP: 3.1X10-5 mPa (20 °C); 8.8X10-5 mPa (25 °C) |
Chemical Identifiers
| CAS Number | 141776-32-1 |
|---|---|
| SMILES | CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC |
| InChIKey | RBSXHDIPCIWOMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
磺酰磺隆 (CAS 141776-32-1), with molecular formula C16H18N6O7S2 and molecular weight 470.07 g/mol. IUPAC: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea.
Chemical Property Profile of 磺酰磺隆
Property Insights of 磺酰磺隆
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 磺酰磺隆. The TPSA of 188.0 Ų indicates high polarity, suggesting 磺酰磺隆 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 磺酰磺隆 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 磺酰磺隆?
The CAS number of 磺酰磺隆 is 141776-32-1.
What is the molecular formula of 磺酰磺隆?
The molecular formula of 磺酰磺隆 is C16H18N6O7S2.
What is the molecular weight of 磺酰磺隆?
The molecular weight of 磺酰磺隆 is 470.07 g/mol.
Where can I buy 磺酰磺隆?
You can request a quote for 磺酰磺隆 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磺酰磺隆?
Yes, KEHONG BIO provides custom synthesis services for 磺酰磺隆 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.