N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine
TL;DR: N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine (CAS 899397-77-4) is a chemical compound with molecular formula C19H27N5S and molecular weight 357.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[(5-ethyl-6,8-dimethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanamine
Also Known As: N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine, N,N-diethyl-2-[(5-ethyl-6,8-dimethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanamine, N,N-diethyl-2-[(5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanamine
| Molecular Formula | C19H27N5S |
|---|---|
| Molecular Weight | 357.20 g/mol |
| LogP | 4.05014 |
| Topological Polar Surface Area | 46.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.19873 |
| Heavy Atoms | 25 |
| Complexity | 882.52356 |
Chemical Identifiers
| CAS Number | 899397-77-4 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2C3=C1N=C(N=N3)SCCN(CC)CC)C)C |
Product Overview
N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine (CAS 899397-77-4), with molecular formula C19H27N5S and molecular weight 357.20 g/mol. IUPAC: N,N-diethyl-2-[(5-ethyl-6,8-dimethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanamine.
Chemical Property Profile of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine
Property Insights of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine
The XLogP value of 4.05014 indicates that N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.84 Ų, N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine 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 N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine?
The CAS number of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine is 899397-77-4.
What is the molecular formula of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine?
The molecular formula of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine is C19H27N5S.
What is the molecular weight of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine?
The molecular weight of N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine is 357.20 g/mol.
Where can I buy N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine?
You can request a quote for N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-2-((5-ethyl-6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.