(4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide
TL;DR: (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide (CAS 108586-76-1) is a chemical compound with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-[hydroxy(phenyl)methylidene]-2,5,7-trimethyl-1,1-dioxopyrido[3,2-e]thiazin-4-one
Also Known As: (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide, Methanone, (4-hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenyl-, S,S-dioxide, (3Z)-3-[hydroxy(phenyl)methylidene]-2,5,7-trimethyl-1,1-dioxopyrido[3,2-e]thiazin-4-one
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08 g/mol |
| LogP | 2.44204 |
| Topological Polar Surface Area | 87.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 979.1502 |
Chemical Identifiers
| CAS Number | 108586-76-1 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C(=O)/C(=C(\C3=CC=CC=C3)/O)/N(S2(=O)=O)C)C |
Product Overview
(4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide (CAS 108586-76-1), with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol. IUPAC: (3Z)-3-[hydroxy(phenyl)methylidene]-2,5,7-trimethyl-1,1-dioxopyrido[3,2-e]thiazin-4-one.
Chemical Property Profile of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide
Property Insights of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide
The XLogP value of 2.44204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide. The TPSA of 87.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide. Following Lipinski's Rule of Five, (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide has 1 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 (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide?
The CAS number of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide is 108586-76-1.
What is the molecular formula of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide?
The molecular formula of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide is C17H16N2O4S.
What is the molecular weight of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide?
The molecular weight of (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide is 344.08 g/mol.
Where can I buy (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide?
You can request a quote for (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide?
Yes, KEHONG BIO provides custom synthesis services for (4-Hydroxy-2,5,7-trimethyl-2H-pyrido(3,2-e)-1,2-thiazin-3-yl)phenylmethanone S,S-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.