TL;DR: N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline (CAS 799827-64-8) is a chemical compound with molecular formula C17H15N5S and molecular weight 321.10483 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Also Known As: N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline, N,N-dimethyl-4-(3-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline, N,N-dimethyl-4-(2-phenyl-6-thia-1,3,4,8-tetrazabicyclo[3.3.0]octa-2,4,7-trien-7-yl)aniline
| Molecular Formula | C17H15N5S |
| Molecular Weight | 321.10483 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.10483 Da |
| Heavy Atoms | 23 |
| Complexity | 392.0 |
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC=CC=C4 |
| InChIKey | HMEDISWIHLXMAB-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline. Following Lipinski's Rule of Five, N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline is 799827-64-8.
The molecular formula of N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline is C17H15N5S.
The molecular weight of N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline is 321.10483 g/mol.
You can request a quote for N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for N,N-dimethyl-4-(3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 799827-64-8. Our professional technical team will respond with pricing and lead time.