(E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide
TL;DR: (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide (CAS 315201-67-3) is a chemical compound with molecular formula C21H22N4O4S3 and molecular weight 490.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[(E)-(2,4,6-trimethoxyphenyl)methylideneamino]acetamide
Also Known As: (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide, 2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[(E)-(2,4,6-trimethoxyphenyl)methylideneamino]acetamide, 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide, 2-{[5-(benzylthio)-1,3,4-thiadiazol-2-yl]thio}-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide, N-[(1E)-2-(2,4,6-trimethoxyphenyl)-1-azavinyl]-2-[5-(phenylmethylthio)(1,3,4-t hiadiazol-2-ylthio)]acetamide
| Molecular Formula | C21H22N4O4S3 |
|---|---|
| Molecular Weight | 490.08 g/mol |
| LogP | 4.0986 |
| Topological Polar Surface Area | 94.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 490.08032 |
| Heavy Atoms | 32 |
| Complexity | 1035.2032 |
Chemical Identifiers
| CAS Number | 315201-67-3 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)OC)/C=N/NC(=O)CSC2=NN=C(S2)SCC3=CC=CC=C3)OC |
Product Overview
(E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide (CAS 315201-67-3), with molecular formula C21H22N4O4S3 and molecular weight 490.08 g/mol. IUPAC: 2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[(E)-(2,4,6-trimethoxyphenyl)methylideneamino]acetamide.
Chemical Property Profile of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide
Property Insights of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide
The XLogP value of 4.0986 indicates that (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.93 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide has 1 hydrogen bond donor(s) and 10 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-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide?
The CAS number of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide is 315201-67-3.
What is the molecular formula of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide?
The molecular formula of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide is C21H22N4O4S3.
What is the molecular weight of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide?
The molecular weight of (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide is 490.08 g/mol.
Where can I buy (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide?
You can request a quote for (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)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-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)-N'-(2,4,6-trimethoxybenzylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.