5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine
TL;DR: 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine (CAS 1354486-09-1) is a chemical compound with molecular formula C10H11N3S and molecular weight 205.06737 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine
Also Known As: 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine, Aripiprazole Impurity 56, 5-(p-Tolyl)-6H-1,3,4-thiadiazin-2-amine, J2.748.161B, 6H-[1,3,4]Thiadiazine, 2-amino-5-(p-tolyl)-
Technical Specifications
| Molecular Formula | C10H11N3S |
| Molecular Weight | 205.06737 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.06737 Da |
| Heavy Atoms | 14 |
| Complexity | 265.0 |
| SMILES | CC1=CC=C(C=C1)C2=NN=C(SC2)N |
| InChIKey | UNRIOSZJTUNHIA-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine
Property Insights of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine. Following Lipinski's Rule of Five, 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine?
The CAS number of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine is 1354486-09-1.
What is the molecular formula of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine?
The molecular formula of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine is C10H11N3S.
What is the molecular weight of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine?
The molecular weight of 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine is 205.06737 g/mol.
Where can I buy 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine?
You can request a quote for 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine?
Yes, CoreyChem provides custom synthesis services for 5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.