6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate
TL;DR: 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate (CAS 73672-78-3) is a chemical compound with molecular formula C17H11NO3S and molecular weight 309.05 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) benzoate
Also Known As: 4-Benzoyl-6-oxo-2-phenyl-1,3-thiazine, 4-benzoyl-2-phenyl-1,3-thiazin-6-one, 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate, (6-oxo-2-phenyl-1,3-thiazin-4-yl) benzoate, 6H-1,3-Thiazin-6-one, 4-(benzoyloxy)-2-phenyl-
| Molecular Formula | C17H11NO3S |
|---|---|
| Molecular Weight | 309.05 g/mol |
| LogP | 3.3895 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.04596 |
| Heavy Atoms | 22 |
| Complexity | 844.53784 |
Chemical Identifiers
| CAS Number | 73672-78-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC(=O)S2)OC(=O)C3=CC=CC=C3 |
Product Overview
6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate (CAS 73672-78-3), with molecular formula C17H11NO3S and molecular weight 309.05 g/mol. IUPAC: (6-oxo-2-phenyl-1,3-thiazin-4-yl) benzoate.
Chemical Property Profile of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate
Property Insights of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate
The XLogP value of 3.3895 indicates that 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate has 0 hydrogen bond donor(s) and 5 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-, benzoate?
The CAS number of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate is 73672-78-3.
What is the molecular formula of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate?
The molecular formula of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate is C17H11NO3S.
What is the molecular weight of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate?
The molecular weight of 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate is 309.05 g/mol.
Where can I buy 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate?
You can request a quote for 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate 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-, benzoate?
Yes, KEHONG BIO provides custom synthesis services for 6H-1,3-Thiazin-6-one, 4-hydroxy-2-phenyl-, benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.