2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide
TL;DR: 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide (CAS 5552-60-3) is a chemical compound with molecular formula C14H16Cl2N4O3S2 and molecular weight 422.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide
Also Known As: 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide, 2-[(6,8-Dichloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-ethylacetamide
| Molecular Formula | C14H16Cl2N4O3S2 |
|---|---|
| Molecular Weight | 422.00 g/mol |
| LogP | 2.1638 |
| Topological Polar Surface Area | 84.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.0041 |
| Heavy Atoms | 25 |
| Complexity | 916.1828 |
Chemical Identifiers
| CAS Number | 5552-60-3 |
|---|---|
| SMILES | CCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NN=C3N2C=C(C=C3Cl)Cl |
Product Overview
2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide (CAS 5552-60-3), with molecular formula C14H16Cl2N4O3S2 and molecular weight 422.00 g/mol. IUPAC: 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide.
Chemical Property Profile of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide
Property Insights of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide
The XLogP value of 2.1638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide. The TPSA of 84.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide. Following Lipinski's Rule of Five, 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide 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 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide?
The CAS number of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide is 5552-60-3.
What is the molecular formula of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide?
The molecular formula of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide is C14H16Cl2N4O3S2.
What is the molecular weight of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide?
The molecular weight of 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide is 422.00 g/mol.
Where can I buy 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide?
You can request a quote for 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.