(5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide
TL;DR: (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide (CAS 299965-34-7) is a chemical compound with molecular formula C21H21ClN4O3S2 and molecular weight 476.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Also Known As: (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide, (E)-N'-(4-((2-chlorobenzyl)oxy)-3-ethoxybenzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide, N'-[(E)-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide, N-[(E)-[4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
| Molecular Formula | C21H21ClN4O3S2 |
|---|---|
| Molecular Weight | 476.07 g/mol |
| LogP | 4.72002 |
| Topological Polar Surface Area | 85.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 476.07437 |
| Heavy Atoms | 31 |
| Complexity | 1058.609 |
Chemical Identifiers
| CAS Number | 299965-34-7 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=N/NC(=O)CSC2=NN=C(S2)C)OCC3=CC=CC=C3Cl |
Product Overview
(5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide (CAS 299965-34-7), with molecular formula C21H21ClN4O3S2 and molecular weight 476.07 g/mol. IUPAC: N-[(E)-[4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide
Property Insights of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide
The XLogP value of 4.72002 indicates that (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide. Following Lipinski's Rule of Five, (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide has 1 hydrogen bond donor(s) and 8 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 (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide?
The CAS number of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide is 299965-34-7.
What is the molecular formula of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide?
The molecular formula of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide is C21H21ClN4O3S2.
What is the molecular weight of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide?
The molecular weight of (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide is 476.07 g/mol.
Where can I buy (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide?
You can request a quote for (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide?
Yes, KEHONG BIO provides custom synthesis services for (5-Methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-acetic acid [1-[4-(2-chloro-benzyloxy)-3-ethoxy-phenyl]-meth-(E)-ylidene]-hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.