Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-
TL;DR: Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- (CAS 60750-75-6) is a chemical compound with molecular formula C8H8N2OS and molecular weight 180.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-[1,2]thiazolo[5,4-b]pyridin-3-one
Also Known As: 4,6-Dimethylisothiazolo[5,4-b]pyridin-3(2H)-one, 4,6-dimethyl-2H,3H-[1,2]thiazolo[5,4-b]pyridin-3-one, 4,6-dimethyl-[1,2]thiazolo[5,4-b]pyridin-3-one, 2H-4,6-Dimethylpyrido(3,2-d)isothiazolin-3-one, Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-
| Molecular Formula | C8H8N2OS |
|---|---|
| Molecular Weight | 180.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 67.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.03574 |
| Heavy Atoms | 12 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 60750-75-6 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C(=O)NS2)C |
| InChIKey | LXCCCCOECARKEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- (CAS 60750-75-6), with molecular formula C8H8N2OS and molecular weight 180.04 g/mol. IUPAC: 4,6-dimethyl-[1,2]thiazolo[5,4-b]pyridin-3-one.
Chemical Property Profile of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-
Property Insights of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-. The TPSA of 67.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-. Following Lipinski's Rule of Five, Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- has 1 hydrogen bond donor(s) and 3 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-?
The CAS number of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- is 60750-75-6.
What is the molecular formula of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-?
The molecular formula of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- is C8H8N2OS.
What is the molecular weight of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-?
The molecular weight of Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- is 180.04 g/mol.
Where can I buy Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl-?
You can request a quote for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- 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-?
Yes, KEHONG BIO provides custom synthesis services for Isothiazolo(5,4-b)pyridin-3(2H)-one, 4,6-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.