6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione
TL;DR: 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione (CAS 379697-13-9) is a chemical compound with molecular formula C13H10N4O2S2 and molecular weight 318.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione
Also Known As: 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione, 6-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione, 6-{[(2-phenyl-1,3-thiazol-4-yl)methyl]sulfanyl}-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione
| Molecular Formula | C13H10N4O2S2 |
|---|---|
| Molecular Weight | 318.02 g/mol |
| LogP | 1.874 |
| Topological Polar Surface Area | 91.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.0245 |
| Heavy Atoms | 21 |
| Complexity | 854.10785 |
Chemical Identifiers
| CAS Number | 379697-13-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CS2)CSC3=NNC(=O)NC3=O |
Product Overview
6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione (CAS 379697-13-9), with molecular formula C13H10N4O2S2 and molecular weight 318.02 g/mol. IUPAC: 6-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione
Property Insights of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione
The XLogP value of 1.874 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione. The TPSA of 91.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione. Following Lipinski's Rule of Five, 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione has 2 hydrogen bond donor(s) and 6 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 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
The CAS number of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione is 379697-13-9.
What is the molecular formula of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular formula of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione is C13H10N4O2S2.
What is the molecular weight of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular weight of 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione is 318.02 g/mol.
Where can I buy 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
You can request a quote for 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(((2-Phenylthiazol-4-yl)methyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.