5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione
TL;DR: 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione (CAS 865615-35-6) is a chemical compound with molecular formula C11H12N4S and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione
Also Known As: 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione, 5-((2,4-dimethylphenyl)amino)-1,2,4-triazine-3(2H)-thione, F1586-0005, 5-[(2,4-dimethylphenyl)amino]-2,3-dihydro-1,2,4-triazine-3-thione
| Molecular Formula | C11H12N4S |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 2.89463 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.07826 |
| Heavy Atoms | 16 |
| Complexity | 561.9062 |
Chemical Identifiers
| CAS Number | 865615-35-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC2=NC(=S)NN=C2)C |
Product Overview
5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione (CAS 865615-35-6), with molecular formula C11H12N4S and molecular weight 232.08 g/mol. IUPAC: 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione.
Chemical Property Profile of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione
Property Insights of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione
The XLogP value of 2.89463 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione. With a topological polar surface area (TPSA) of 53.6 Ų, 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione has 2 hydrogen bond donor(s) and 4 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 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione?
The CAS number of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione is 865615-35-6.
What is the molecular formula of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione?
The molecular formula of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione is C11H12N4S.
What is the molecular weight of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione?
The molecular weight of 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione is 232.08 g/mol.
Where can I buy 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione?
You can request a quote for 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,4-dimethylanilino)-2H-1,2,4-triazine-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.