![N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline structure](/static/products/879/879562-81-9.png)
N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline
TL;DR: N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline (CAS 879562-81-9) is a chemical compound with molecular formula C17H14N6O2S and molecular weight 366.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-[6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]aniline
Also Known As: N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline, N,N-dimethyl-4-[6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]aniline, N,N-dimethyl-4-[6-(3-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]aniline
| Molecular Formula | C17H14N6O2S |
|---|---|
| Molecular Weight | 366.09 g/mol |
| LogP | 3.494 |
| Topological Polar Surface Area | 89.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.0899 |
| Heavy Atoms | 26 |
| Complexity | 1100.1041 |
Chemical Identifiers
| CAS Number | 879562-81-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline (CAS 879562-81-9), with molecular formula C17H14N6O2S and molecular weight 366.09 g/mol. IUPAC: N,N-dimethyl-4-[6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]aniline.
Chemical Property Profile of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline
Property Insights of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline
The XLogP value of 3.494 indicates that N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.46 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline. Following Lipinski's Rule of Five, N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline has 0 hydrogen bond donor(s) and 7 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 N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline?
The CAS number of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline is 879562-81-9.
What is the molecular formula of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline?
The molecular formula of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline is C17H14N6O2S.
What is the molecular weight of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline?
The molecular weight of N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline is 366.09 g/mol.
Where can I buy N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline?
You can request a quote for N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-4-(6-(3-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.