6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate
TL;DR: 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate (CAS 73672-86-3) is a chemical compound with molecular formula C17H13NO4S2 and molecular weight 359.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-oxo-2-phenyl-1,3-thiazin-4-yl) 4-methylbenzenesulfonate
Also Known As: 2-Phenyl-4-tosyl-6-oxo-1,3-thiazine, 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate, p-Toluenesulfonic acid, 6-oxo-2-phenyl-6H-1,3-thiazin-4-yl ester, (6-oxo-2-phenyl-1,3-thiazin-4-yl) 4-methylbenzenesulfonate, 6-Oxo-2-phenyl-6H-1,3-thiazin-4-yl 4-methylbenzene-1-sulfonate
| Molecular Formula | C17H13NO4S2 |
|---|---|
| Molecular Weight | 359.03 g/mol |
| LogP | 3.24642 |
| Topological Polar Surface Area | 73.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.0286 |
| Heavy Atoms | 24 |
| Complexity | 1010.4611 |
Chemical Identifiers
| CAS Number | 73672-86-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)SC(=N2)C3=CC=CC=C3 |
Product Overview
6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate (CAS 73672-86-3), with molecular formula C17H13NO4S2 and molecular weight 359.03 g/mol. IUPAC: (6-oxo-2-phenyl-1,3-thiazin-4-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate
Property Insights of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate
The XLogP value of 3.24642 indicates that 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate. Following Lipinski's Rule of Five, 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate has 0 hydrogen bond donor(s) and 6 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 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate?
The CAS number of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate is 73672-86-3.
What is the molecular formula of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate?
The molecular formula of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate is C17H13NO4S2.
What is the molecular weight of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate?
The molecular weight of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate is 359.03 g/mol.
Where can I buy 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate?
You can request a quote for 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, p-toluenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.