2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide
TL;DR: 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide (CAS 1584698-57-6) is a chemical compound with molecular formula C15H14BrN3S and molecular weight 347.0092 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-N,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine bromide
Also Known As: 2-methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide, F1311-0018, 2-methyl-N,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine bromide, 2-methyl-N,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine;bromide, 2-methyl-N,3-diphenyl-1-thia-4-aza-2-azoniacyclopenta-2,4-dien-5-amine Bromide
Technical Specifications
| Molecular Formula | C15H14BrN3S |
| Molecular Weight | 347.0092 g/mol |
| XLogP | 0.3822 |
| Topological Polar Surface Area (TPSA) | 57.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.0092 Da |
| Heavy Atoms | 20 |
| Complexity | 275.0 |
| SMILES | C[N+]1=C(N=C(S1)NC2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
| InChIKey | YTLSPCXUPCTKNJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide
Property Insights of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide
The XLogP value of 0.3822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide. With a topological polar surface area (TPSA) of 57.0 Ų, 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide has 1 hydrogen bond donor(s) and 4 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-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide?
The CAS number of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide is 1584698-57-6.
What is the molecular formula of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide?
The molecular formula of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide is C15H14BrN3S.
What is the molecular weight of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide?
The molecular weight of 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide is 347.0092 g/mol.
Where can I buy 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide?
You can request a quote for 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-3-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.