![9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole structure](/static/products/841/841213-91-0.png)
9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole
TL;DR: 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole (CAS 841213-91-0) is a chemical compound with molecular formula C16H12ClN5OS and molecular weight 357.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-6-methoxy-3-(pyridin-2-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
Also Known As: ASN 07192317, 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole, 9-chloro-6-methoxy-3-(pyridin-2-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
| Molecular Formula | C16H12ClN5OS |
|---|---|
| Molecular Weight | 357.05 g/mol |
| LogP | 3.8554 |
| Topological Polar Surface Area | 76.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.0451 |
| Heavy Atoms | 24 |
| Complexity | 1021.26587 |
Chemical Identifiers
| CAS Number | 841213-91-0 |
|---|---|
| SMILES | COC1=C2C(=C(C=C1)Cl)C3=C(N2)N=C(N=N3)SCC4=CC=CC=N4 |
Product Overview
9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole (CAS 841213-91-0), with molecular formula C16H12ClN5OS and molecular weight 357.05 g/mol. IUPAC: 9-chloro-6-methoxy-3-(pyridin-2-ylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole.
Chemical Property Profile of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole
Property Insights of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole
The XLogP value of 3.8554 indicates that 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole. Following Lipinski's Rule of Five, 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole 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 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole?
The CAS number of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole is 841213-91-0.
What is the molecular formula of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole?
The molecular formula of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole is C16H12ClN5OS.
What is the molecular weight of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole?
The molecular weight of 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole is 357.05 g/mol.
Where can I buy 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole?
You can request a quote for 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[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 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 9-Chloro-6-methoxy-3-((pyridin-2-ylmethyl)thio)-5H-[1,2,4]triazino[5,6-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.