RefChem:399103
TL;DR: RefChem:399103 (CAS 606955-98-0) is a chemical compound with molecular formula C13H8FN3O2S and molecular weight 289.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(3-fluorophenyl)methylidene]-6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
Also Known As: SDCCGMLS-0065101.P001, 2-(3-Fluorobenzylidene)-6-methyl-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione, (2Z)-2-(3-fluorobenzylidene)-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione, (2Z)-2-[(3-fluorophenyl)methylidene]-6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione, 2-(3-fluorobenzylidene)-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
| Molecular Formula | C13H8FN3O2S |
|---|---|
| Molecular Weight | 289.03 g/mol |
| LogP | 0.50642 |
| Topological Polar Surface Area | 64.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.03214 |
| Heavy Atoms | 20 |
| Complexity | 977.4254 |
Chemical Identifiers
| CAS Number | 606955-98-0 |
|---|---|
| SMILES | CC1=NN2C(=O)/C(=C/C3=CC(=CC=C3)F)/SC2=NC1=O |
Product Overview
RefChem:399103 (CAS 606955-98-0), with molecular formula C13H8FN3O2S and molecular weight 289.03 g/mol. IUPAC: (2Z)-2-[(3-fluorophenyl)methylidene]-6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione.
Chemical Property Profile of RefChem:399103
Property Insights of RefChem:399103
The XLogP value of 0.50642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:399103. The TPSA of 64.33 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:399103. Following Lipinski's Rule of Five, RefChem:399103 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 RefChem:399103?
The CAS number of RefChem:399103 is 606955-98-0.
What is the molecular formula of RefChem:399103?
The molecular formula of RefChem:399103 is C13H8FN3O2S.
What is the molecular weight of RefChem:399103?
The molecular weight of RefChem:399103 is 289.03 g/mol.
Where can I buy RefChem:399103?
You can request a quote for RefChem:399103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:399103?
Yes, KEHONG BIO provides custom synthesis services for RefChem:399103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.