(E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide
TL;DR: (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide (CAS 844858-81-7) is a chemical compound with molecular formula C21H18N6O3S2 and molecular weight 466.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-cyanophenyl)-N'-[(E)-[4-methoxy-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]methylideneamino]oxamide
Also Known As: (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide, N-(4-cyanophenyl)-2-[(2E)-2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazinyl]-2-oxoacetamide, N-(4-cyanophenyl)-N'-[(E)-[4-methoxy-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]methylideneamino]oxamide
| Molecular Formula | C21H18N6O3S2 |
|---|---|
| Molecular Weight | 466.09 g/mol |
| LogP | 3.1079 |
| Topological Polar Surface Area | 129.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.0882 |
| Heavy Atoms | 32 |
| Complexity | 1184.9908 |
Chemical Identifiers
| CAS Number | 844858-81-7 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC2=C(C=CC(=C2)/C=N/NC(=O)C(=O)NC3=CC=C(C=C3)C#N)OC |
Product Overview
(E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide (CAS 844858-81-7), with molecular formula C21H18N6O3S2 and molecular weight 466.09 g/mol. IUPAC: N-(4-cyanophenyl)-N'-[(E)-[4-methoxy-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]methylideneamino]oxamide.
Chemical Property Profile of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide
Property Insights of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide
The XLogP value of 3.1079 indicates that (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.36 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide. Following Lipinski's Rule of Five, (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide has 2 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)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide?
The CAS number of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide is 844858-81-7.
What is the molecular formula of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide?
The molecular formula of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide is C21H18N6O3S2.
What is the molecular weight of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide?
The molecular weight of (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide is 466.09 g/mol.
Where can I buy (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide?
You can request a quote for (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(4-cyanophenyl)-2-(2-(4-methoxy-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)benzylidene)hydrazinyl)-2-oxoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.