![5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole structure](/static/products/112/112800-86-9.png)
5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole
TL;DR: 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole (CAS 112800-86-9) is a chemical compound with molecular formula C12H12N4S and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole
Also Known As: BIM-0001282.P001, 5-ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole, 5-ethyl-3-methylthio-1,2,4-triazino[5,6-b]indole, 5-ethyl-3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole, 5-ETHYL-3-(METHYLSULFANYL)-[1,2,4]TRIAZINO[5,6-B]INDOLE
| Molecular Formula | C12H12N4S |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 2.7213 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.07826 |
| Heavy Atoms | 17 |
| Complexity | 689.34515 |
Chemical Identifiers
| CAS Number | 112800-86-9 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SC |
Product Overview
5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole (CAS 112800-86-9), with molecular formula C12H12N4S and molecular weight 244.08 g/mol. IUPAC: 5-ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole.
Chemical Property Profile of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole
Property Insights of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole
The XLogP value of 2.7213 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole. With a topological polar surface area (TPSA) of 43.6 Ų, 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole has 0 hydrogen bond donor(s) and 4 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 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole?
The CAS number of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole is 112800-86-9.
What is the molecular formula of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole?
The molecular formula of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole is C12H12N4S.
What is the molecular weight of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole?
The molecular weight of 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole is 244.08 g/mol.
Where can I buy 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole?
You can request a quote for 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.