![2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one structure](/static/products/1307/130747-42-1.webp)
2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
TL;DR: 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one (CAS 130747-42-1) is a chemical compound with molecular formula C9H6N4OS and molecular weight 218.02623 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
Also Known As: 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one, BAS 02588704, 2-Amino-9-thia-1,3,4a-triaza-fluoren-4-one, AB00105157-01, 2-Amino-4H-s-triazino[2,1-b]benzothiazole-4-one
Technical Specifications
| Molecular Formula | C9H6N4OS |
| Molecular Weight | 218.02623 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 96.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.02623 Da |
| Heavy Atoms | 15 |
| Complexity | 378.0 |
| SMILES | C1=CC=C2C(=C1)N3C(=NC(=NC3=O)N)S2 |
| InChIKey | FRROVMLBBCPUFU-UHFFFAOYSA-N |
Chemical Property Profile of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
Property Insights of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one. Following Lipinski's Rule of Five, 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one?
The CAS number of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one is 130747-42-1.
What is the molecular formula of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one?
The molecular formula of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one is C9H6N4OS.
What is the molecular weight of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one?
The molecular weight of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one is 218.02623 g/mol.
Where can I buy 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one?
You can request a quote for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one?
Yes, CoreyChem provides custom synthesis services for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.