(E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide
TL;DR: (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide (CAS 487024-72-6) is a chemical compound with molecular formula C18H14ClN5O3S3 and molecular weight 478.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide
Also Known As: (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide, 2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide
| Molecular Formula | C18H14ClN5O3S3 |
|---|---|
| Molecular Weight | 478.99 g/mol |
| LogP | 4.6344 |
| Topological Polar Surface Area | 110.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 478.99472 |
| Heavy Atoms | 30 |
| Complexity | 1076.4803 |
Chemical Identifiers
| CAS Number | 487024-72-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC2=NN=C(S2)SCC(=O)N/N=C/C3=CC=CC=C3[N+](=O)[O-])Cl |
Product Overview
(E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide (CAS 487024-72-6), with molecular formula C18H14ClN5O3S3 and molecular weight 478.99 g/mol. IUPAC: 2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide.
Chemical Property Profile of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide
Property Insights of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide
The XLogP value of 4.6344 indicates that (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.38 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide 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-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide?
The CAS number of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide is 487024-72-6.
What is the molecular formula of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide?
The molecular formula of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide is C18H14ClN5O3S3.
What is the molecular weight of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide?
The molecular weight of (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide is 478.99 g/mol.
Where can I buy (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide?
You can request a quote for (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.