(E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide
TL;DR: (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide (CAS 497078-75-8) is a chemical compound with molecular formula C18H14N6O6S2 and molecular weight 474.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[3-(2,4-dinitrophenoxy)phenyl]methylideneamino]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Also Known As: (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide, N'-{(E)-[3-(2,4-dinitrophenoxy)phenyl]methylidene}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide, N-[(E)-[3-(2,4-dinitrophenoxy)phenyl]methylideneamino]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
| Molecular Formula | C18H14N6O6S2 |
|---|---|
| Molecular Weight | 474.04 g/mol |
| LogP | 3.69762 |
| Topological Polar Surface Area | 162.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.04163 |
| Heavy Atoms | 32 |
| Complexity | 1198.2081 |
Chemical Identifiers
| CAS Number | 497078-75-8 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC(=O)N/N=C/C2=CC(=CC=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
(E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide (CAS 497078-75-8), with molecular formula C18H14N6O6S2 and molecular weight 474.04 g/mol. IUPAC: N-[(E)-[3-(2,4-dinitrophenoxy)phenyl]methylideneamino]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide
Property Insights of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide
The XLogP value of 3.69762 indicates that (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.75 Ų indicates high polarity, suggesting (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide?
The CAS number of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide is 497078-75-8.
What is the molecular formula of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide?
The molecular formula of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide is C18H14N6O6S2.
What is the molecular weight of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide?
The molecular weight of (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide is 474.04 g/mol.
Where can I buy (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide?
You can request a quote for (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(3-(2,4-dinitrophenoxy)benzylidene)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.