![4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline structure](/static/products/902/902041-41-2.png)
4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline
TL;DR: 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline (CAS 902041-41-2) is a chemical compound with molecular formula C20H19N5O2S and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline
Also Known As: 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline, 4-[6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline, 4-[6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline
| Molecular Formula | C20H19N5O2S |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 3.2808 |
| Topological Polar Surface Area | 64.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.12595 |
| Heavy Atoms | 28 |
| Complexity | 1133.4222 |
Chemical Identifiers
| CAS Number | 902041-41-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)CC4=CC5=C(C=C4)OCCO5 |
Product Overview
4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline (CAS 902041-41-2), with molecular formula C20H19N5O2S and molecular weight 393.13 g/mol. IUPAC: 4-[6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-N,N-dimethylaniline.
Chemical Property Profile of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline
Property Insights of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline
The XLogP value of 3.2808 indicates that 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline. Following Lipinski's Rule of Five, 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline 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 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline?
The CAS number of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline is 902041-41-2.
What is the molecular formula of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline?
The molecular formula of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline is C20H19N5O2S.
What is the molecular weight of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline?
The molecular weight of 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline is 393.13 g/mol.
Where can I buy 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline?
You can request a quote for 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)-N,N-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.