![(2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide structure](/static/products/498/498571-93-0.png)
(2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide
TL;DR: (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide (CAS 498571-93-0) is a chemical compound with molecular formula C16H19N5OS4 and molecular weight 425.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[2-(ethylamino)-2-sulfanylideneethylidene]amino]-2-[[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
Also Known As: (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide, (E)-N-ethyl-2-(2-(2-((5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)acetyl)hydrazono)ethanethioamide, N-[(1E)-3-(ethylamino)-3-thioxo-1-azaprop-1-enyl]-2-{5-[(4-methylphenyl)methyl thio](1,3,4-thiadiazol-2-ylthio)}acetamide, N-[(E)-[2-(ethylamino)-2-sulfanylideneethylidene]amino]-2-[[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
| Molecular Formula | C16H19N5OS4 |
|---|---|
| Molecular Weight | 425.05 g/mol |
| LogP | 3.26982 |
| Topological Polar Surface Area | 79.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 425.04724 |
| Heavy Atoms | 26 |
| Complexity | 760.25555 |
Chemical Identifiers
| CAS Number | 498571-93-0 |
|---|---|
| SMILES | CCNC(=S)/C=N/NC(=O)CSC1=NN=C(S1)SCC2=CC=C(C=C2)C |
Product Overview
(2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide (CAS 498571-93-0), with molecular formula C16H19N5OS4 and molecular weight 425.05 g/mol. IUPAC: N-[(E)-[2-(ethylamino)-2-sulfanylideneethylidene]amino]-2-[[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide
Property Insights of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide
The XLogP value of 3.26982 indicates that (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide. Following Lipinski's Rule of Five, (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide has 2 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 (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide?
The CAS number of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide is 498571-93-0.
What is the molecular formula of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide?
The molecular formula of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide is C16H19N5OS4.
What is the molecular weight of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide?
The molecular weight of (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide is 425.05 g/mol.
Where can I buy (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide?
You can request a quote for (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-ethyl-2-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.