![6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine structure](/static/products/573/573697-40-2.png)
6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
TL;DR: 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (CAS 573697-40-2) is a chemical compound with molecular formula C17H11ClN4O2S and molecular weight 370.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Also Known As: 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, 6-(2H-1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, 6-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-3-(3-chlorophenyl)-7H-1,2,4-triazolo[3,4- b]1,3,4-thiadiazine, 6-(benzo[d][1,3]dioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
| Molecular Formula | C17H11ClN4O2S |
|---|---|
| Molecular Weight | 370.03 g/mol |
| LogP | 3.6853 |
| Topological Polar Surface Area | 61.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.0291 |
| Heavy Atoms | 25 |
| Complexity | 1017.6325 |
Chemical Identifiers
| CAS Number | 573697-40-2 |
|---|---|
| SMILES | C1C(=NN2C(=NN=C2S1)C3=CC(=CC=C3)Cl)C4=CC5=C(C=C4)OCO5 |
Product Overview
6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (CAS 573697-40-2), with molecular formula C17H11ClN4O2S and molecular weight 370.03 g/mol. IUPAC: 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine.
Chemical Property Profile of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Property Insights of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
The XLogP value of 3.6853 indicates that 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine. Following Lipinski's Rule of Five, 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 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 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
The CAS number of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 573697-40-2.
What is the molecular formula of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
The molecular formula of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is C17H11ClN4O2S.
What is the molecular weight of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
The molecular weight of 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 370.03 g/mol.
Where can I buy 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
You can request a quote for 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
Yes, KEHONG BIO provides custom synthesis services for 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.