Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide
TL;DR: Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide (CAS 108361-85-9) is a chemical compound with molecular formula C16H14N2O4S and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-1,1-dioxo-2-phenacyl-[1,2]thiazolo[5,4-b]pyridin-3-one
Also Known As: Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide, 4,6-dimethyl-1,1-dioxo-2-phenacyl-[1,2]thiazolo[5,4-b]pyridin-3-one, 4,6-Dimethyl-2-(2-oxo-2-phenylethyl)isothiazolo(5,4-b)pyridin-3(2H)-one 1,1-dioxide, 4,6-dimethyl-1,1-dioxo-2-phenacyl-isothiazolo[5,4-b]pyridin-3-one, 2H-2-phenacyl-4,6-dimethylpyrido<3,2-d>isothiazoline-3-one-1,1-dioxide
| Molecular Formula | C16H14N2O4S |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 92.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.0674 |
| Heavy Atoms | 23 |
| Complexity | 592.0 |
Chemical Identifiers
| CAS Number | 108361-85-9 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C(=O)N(S2(=O)=O)CC(=O)C3=CC=CC=C3)C |
| InChIKey | MVJRNFYKVCYUEI-UHFFFAOYSA-N |
Product Overview
Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide (CAS 108361-85-9), with molecular formula C16H14N2O4S and molecular weight 330.07 g/mol. IUPAC: 4,6-dimethyl-1,1-dioxo-2-phenacyl-[1,2]thiazolo[5,4-b]pyridin-3-one.
Chemical Property Profile of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide
Property Insights of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide. Following Lipinski's Rule of Five, Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide 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 Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide?
The CAS number of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide is 108361-85-9.
What is the molecular formula of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide?
The molecular formula of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide is C16H14N2O4S.
What is the molecular weight of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide?
The molecular weight of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide is 330.07 g/mol.
Where can I buy Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide?
You can request a quote for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-2-(2-oxo-2-phenylethyl)-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.