![3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one structure](/static/products/452/452278-76-1.png)
3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one
TL;DR: 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one (CAS 452278-76-1) is a chemical compound with molecular formula C13H10N4O2S and molecular weight 286.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)oxolan-2-one
Also Known As: 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one, 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)oxolan-2-one, 3-((5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)dihydrofuran-2(3H)-one
| Molecular Formula | C13H10N4O2S |
|---|---|
| Molecular Weight | 286.05 g/mol |
| LogP | 1.9137 |
| Topological Polar Surface Area | 80.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.05246 |
| Heavy Atoms | 20 |
| Complexity | 816.3475 |
Chemical Identifiers
| CAS Number | 452278-76-1 |
|---|---|
| SMILES | C1COC(=O)C1SC2=NC3=C(C4=CC=CC=C4N3)N=N2 |
Product Overview
3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one (CAS 452278-76-1), with molecular formula C13H10N4O2S and molecular weight 286.05 g/mol. IUPAC: 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)oxolan-2-one.
Chemical Property Profile of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one
Property Insights of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one
The XLogP value of 1.9137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one. The TPSA of 80.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one. Following Lipinski's Rule of Five, 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one has 1 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 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one?
The CAS number of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one is 452278-76-1.
What is the molecular formula of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one?
The molecular formula of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one is C13H10N4O2S.
What is the molecular weight of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one?
The molecular weight of 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one is 286.05 g/mol.
Where can I buy 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one?
You can request a quote for 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)dihydrofuran-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.