Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-
TL;DR: Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- (CAS 77803-68-0) is a chemical compound with molecular formula C11H7N3O3S and molecular weight 261.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-, 2-(1,3-Benzodioxol-5-yl)-thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 6-(3,4-Diossimetilenefenil)triazolo(3,2-b)-s-triazol-3(2H)-one, 6-(3,4-Diossimetilenefenil)triazolo(3,2-b)-s-triazol-3(2H)-one [Italian], 2-(1,3-benzodioxol-5-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
| Molecular Formula | C11H7N3O3S |
|---|---|
| Molecular Weight | 261.02 g/mol |
| LogP | 1.4197 |
| Topological Polar Surface Area | 66.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.0208 |
| Heavy Atoms | 18 |
| Complexity | 667.5482 |
Chemical Identifiers
| CAS Number | 77803-68-0 |
|---|---|
| SMILES | C1C(=O)N2C(=NC(=N2)C3=CC4=C(C=C3)OCO4)S1 |
Product Overview
Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- (CAS 77803-68-0), with molecular formula C11H7N3O3S and molecular weight 261.02 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-
Property Insights of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-
The XLogP value of 1.4197 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-. The TPSA of 66.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-. Following Lipinski's Rule of Five, Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- 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 Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-?
The CAS number of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- is 77803-68-0.
What is the molecular formula of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-?
The molecular formula of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- is C11H7N3O3S.
What is the molecular weight of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-?
The molecular weight of Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- is 261.02 g/mol.
Where can I buy Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-?
You can request a quote for Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiazolo(3,2-b)(1,2,4)triazol-6(5H)-one, 2-(1,3-benzodioxol-5-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.