![Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- structure](/static/products/6039/603946-66-3.webp)
Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-
TL;DR: Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- (CAS 603946-66-3) is a chemical compound with molecular formula C14H13N5S and molecular weight 283.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(8-ethyl-5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetonitrile
Also Known As: ASN 06015281, ACETONITRILE,[(8-ETHYL-5-METHYL-5H-1,2,4-TRIAZINO[5,6-B]INDOL-3-YL)THIO]-, (6-Ethyl-9-methyl-9H-1,3,4,9-tetraaza-fluoren-2-ylsulfanyl)-acetonitrile, 2-((8-ethyl-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)acetonitrile, 2-[(8-ethyl-5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetonitrile
| Molecular Formula | C14H13N5S |
|---|---|
| Molecular Weight | 283.09 g/mol |
| LogP | 2.69458 |
| Topological Polar Surface Area | 67.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.08917 |
| Heavy Atoms | 20 |
| Complexity | 830.79846 |
Chemical Identifiers
| CAS Number | 603946-66-3 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SCC#N)C |
Product Overview
Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- (CAS 603946-66-3), with molecular formula C14H13N5S and molecular weight 283.09 g/mol. IUPAC: 2-[(8-ethyl-5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetonitrile.
Chemical Property Profile of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-
Property Insights of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-
The XLogP value of 2.69458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-. The TPSA of 67.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-. Following Lipinski's Rule of Five, Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- has 0 hydrogen bond donor(s) and 5 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 Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-?
The CAS number of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- is 603946-66-3.
What is the molecular formula of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-?
The molecular formula of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- is C14H13N5S.
What is the molecular weight of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-?
The molecular weight of Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- is 283.09 g/mol.
Where can I buy Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-?
You can request a quote for Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]-?
Yes, KEHONG BIO provides custom synthesis services for Acetonitrile,[(8-ethyl-5-methyl-5H-1,2,4-triazino[5,6-B]indol-3-YL)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.