![dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine structure](/static/products/578/578732-91-9.png)
dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine
TL;DR: dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine (CAS 578732-91-9) is a chemical compound with molecular formula C16H14N6S and molecular weight 322.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Also Known As: dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine, N,N-dimethyl-4-(3-(pyridin-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline, N,N-dimethyl-4-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline, N,N-dimethyl-4-[3-(pyridin-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline, N,N-dimethyl-4-[3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline
| Molecular Formula | C16H14N6S |
|---|---|
| Molecular Weight | 322.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.10007 |
| Heavy Atoms | 23 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 578732-91-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC=NC=C4 |
| InChIKey | NSEZKQFLYNSANK-UHFFFAOYSA-N |
Product Overview
dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine (CAS 578732-91-9), with molecular formula C16H14N6S and molecular weight 322.10 g/mol. IUPAC: N,N-dimethyl-4-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline.
Chemical Property Profile of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine
Property Insights of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine. Following Lipinski's Rule of Five, dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine has 0 hydrogen bond donor(s) and 6 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 dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine?
The CAS number of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine is 578732-91-9.
What is the molecular formula of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine?
The molecular formula of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine is C16H14N6S.
What is the molecular weight of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine?
The molecular weight of dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine is 322.10 g/mol.
Where can I buy dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine?
You can request a quote for dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine?
Yes, KEHONG BIO provides custom synthesis services for dimethyl[4-(3-(4-pyridyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl))phenyl ]amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.