1L-417S
TL;DR: 1L-417S (CAS 477866-62-9) is a chemical compound with molecular formula C14H14Cl2N4OS and molecular weight 356.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(2,4-dichlorophenyl)methoxy]-2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenamine
Also Known As: 1L-417S, (E)-N-[(2,4-dichlorophenyl)methoxy]-2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenamine, 5-(2-(((2,4-Dichlorobenzyl)oxy)amino)vinyl)-6-methyl-3-(methylsulfanyl)-1,2,4-triazine, [(2,4-dichlorophenyl)methoxy][(E)-2-[6-methyl-3-(methylsulfanyl)-1,2,4-triazin-5-yl]ethenyl]amine, 5-(2-{[(2,4-dichlorobenzyl)oxy]amino}vinyl)-6-methyl-3-(methylsulfanyl)-1,2,4-triazine
| Molecular Formula | C14H14Cl2N4OS |
|---|---|
| Molecular Weight | 356.03 g/mol |
| LogP | 3.90082 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.02655 |
| Heavy Atoms | 22 |
| Complexity | 681.8876 |
Chemical Identifiers
| CAS Number | 477866-62-9 |
|---|---|
| SMILES | CC1=C(N=C(N=N1)SC)/C=C/NOCC2=C(C=C(C=C2)Cl)Cl |
Product Overview
1L-417S (CAS 477866-62-9), with molecular formula C14H14Cl2N4OS and molecular weight 356.03 g/mol. IUPAC: (E)-N-[(2,4-dichlorophenyl)methoxy]-2-(6-methyl-3-methylsulfanyl-1,2,4-triazin-5-yl)ethenamine.
Chemical Property Profile of 1L-417S
Property Insights of 1L-417S
The XLogP value of 3.90082 indicates that 1L-417S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, 1L-417S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1L-417S 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 1L-417S?
The CAS number of 1L-417S is 477866-62-9.
What is the molecular formula of 1L-417S?
The molecular formula of 1L-417S is C14H14Cl2N4OS.
What is the molecular weight of 1L-417S?
The molecular weight of 1L-417S is 356.03 g/mol.
Where can I buy 1L-417S?
You can request a quote for 1L-417S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1L-417S?
Yes, KEHONG BIO provides custom synthesis services for 1L-417S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.