(E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate
TL;DR: (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate (CAS 299965-27-8) is a chemical compound with molecular formula C20H17ClN4O4S2 and molecular weight 476.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(E)-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate
Also Known As: (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate, [2-methoxy-4-[(E)-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate, 2-methoxy-4-[(E)-(2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenyl 4-chlorobenzoate, 4-{(1E)-2-[2-(5-methyl(1,3,4-thiadiazol-2-ylthio))acetylamino]-2-azavinyl}-2-m ethoxyphenyl 4-chlorobenzoate
| Molecular Formula | C20H17ClN4O4S2 |
|---|---|
| Molecular Weight | 476.04 g/mol |
| LogP | 3.97012 |
| Topological Polar Surface Area | 102.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.03796 |
| Heavy Atoms | 31 |
| Complexity | 1102.8142 |
Chemical Identifiers
| CAS Number | 299965-27-8 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC(=O)N/N=C/C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)Cl)OC |
Product Overview
(E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate (CAS 299965-27-8), with molecular formula C20H17ClN4O4S2 and molecular weight 476.04 g/mol. IUPAC: [2-methoxy-4-[(E)-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate.
Chemical Property Profile of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate
Property Insights of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate
The XLogP value of 3.97012 indicates that (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate. Following Lipinski's Rule of Five, (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate has 1 hydrogen bond donor(s) and 9 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 (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate?
The CAS number of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate is 299965-27-8.
What is the molecular formula of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate?
The molecular formula of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate is C20H17ClN4O4S2.
What is the molecular weight of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate?
The molecular weight of (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate is 476.04 g/mol.
Where can I buy (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate?
You can request a quote for (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-methoxy-4-((2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)methyl)phenyl 4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.