![2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine structure](/static/products/5989/59894-16-5.webp)
2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine
TL;DR: 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine (CAS 59894-16-5) is a chemical compound with molecular formula C11H10N6S and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-imino-7-phenyl-6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazin-2-amine
Also Known As: 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine, 4-imino-7-phenyl-6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazin-, 4-imino-7-phenyl-6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazin-2-amine, 4-imino-7-phenyl-6H-1,3,5-triazino[6,1-b]1,3,4-thiadiazine-2-ylamine, 4-Imino-7-phenyl-4H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazin-2-amine
| Molecular Formula | C11H10N6S |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.06876 |
| Heavy Atoms | 18 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 59894-16-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CSC3=NC(=NC(=N)N3N2)N |
| InChIKey | UPKGXINKIJUCHS-UHFFFAOYSA-N |
Product Overview
2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine (CAS 59894-16-5), with molecular formula C11H10N6S and molecular weight 258.07 g/mol. IUPAC: 4-imino-7-phenyl-6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazin-2-amine.
Chemical Property Profile of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine
Property Insights of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine. Following Lipinski's Rule of Five, 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine has 3 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 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine?
The CAS number of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine is 59894-16-5.
What is the molecular formula of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine?
The molecular formula of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine is C11H10N6S.
What is the molecular weight of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine?
The molecular weight of 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine is 258.07 g/mol.
Where can I buy 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine?
You can request a quote for 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diimino-7-phenyl-3H,6H-[1,3,5]triazino[2,1-b][1,3,4]thiadiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.