ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate
TL;DR: ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate (CAS 1274948-27-4) is a chemical compound with molecular formula C10H11ClFN3S and molecular weight 259.03464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N'-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]carbamimidothioate
Also Known As: AO-990/15068115, ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate, 2,3-diaza-4-(6-chloro-2-fluorophenyl)-1-ethylthiobuta-1,3-dienylamine, hydrochloride
Technical Specifications
| Molecular Formula | C10H11ClFN3S |
| Molecular Weight | 259.03464 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.03464 Da |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
| SMILES | CCS/C(=N\N=C\C1=C(C=CC=C1Cl)F)/N |
| InChIKey | LWBXBSARPHHCEU-MKMNVTDBSA-N |
Chemical Property Profile of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate
Property Insights of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate
The XLogP value of 3.1 indicates that ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate. Following Lipinski's Rule of Five, ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate?
The CAS number of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate is 1274948-27-4.
What is the molecular formula of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate?
The molecular formula of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate is C10H11ClFN3S.
What is the molecular weight of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate?
The molecular weight of ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate is 259.03464 g/mol.
Where can I buy ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate?
You can request a quote for ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate?
Yes, CoreyChem provides custom synthesis services for ethyl N'-(2-chloro-6-fluorobenzylidene)hydrazonothiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.