![5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one structure](/static/products/292/292053-17-9.png)
5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one
TL;DR: 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one (CAS 292053-17-9) is a chemical compound with molecular formula C11H8N4O5S and molecular weight 308.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazine-3,5-dione
Also Known As: 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one, 6-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazine-3,5-dione, 6-[2-(4-nitrophenyl)-2-oxoethylthio]-2H,4H-1,2,4-triazine-3,5-dione, 6-((2-(4-nitrophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione, 6-[2-(4-Nitro-phenyl)-2-oxo-ethylsulfanyl]-2H-[1,2,4]triazine-3,5-dione
| Molecular Formula | C11H8N4O5S |
|---|---|
| Molecular Weight | 308.02 g/mol |
| LogP | 0.3414 |
| Topological Polar Surface Area | 138.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.02155 |
| Heavy Atoms | 21 |
| Complexity | 795.25116 |
Chemical Identifiers
| CAS Number | 292053-17-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CSC2=NNC(=O)NC2=O)[N+](=O)[O-] |
Product Overview
5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one (CAS 292053-17-9), with molecular formula C11H8N4O5S and molecular weight 308.02 g/mol. IUPAC: 6-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one
Property Insights of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one
The XLogP value of 0.3414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one. The TPSA of 138.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one. Following Lipinski's Rule of Five, 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one has 2 hydrogen bond donor(s) and 7 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 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one?
The CAS number of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one is 292053-17-9.
What is the molecular formula of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one?
The molecular formula of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one is C11H8N4O5S.
What is the molecular weight of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one?
The molecular weight of 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one is 308.02 g/mol.
Where can I buy 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one?
You can request a quote for 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-hydroxy-6-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.