(E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate
TL;DR: (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate (CAS 669760-68-3) is a chemical compound with molecular formula C16H13ClN6O2S and molecular weight 388.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2E)-2-[(2-chlorophenyl)hydrazinylidene]-2-(1-phenyltetrazol-5-yl)sulfanylacetate
Also Known As: (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate, methyl (2E)-2-[(2-chlorophenyl)hydrazinylidene]-2-(1-phenyltetrazol-5-yl)sulfanylacetate, acetic acid, [(2-chlorophenyl)hydrazono][(1-phenyl-1H-tetrazol-5-yl)thio]-, methyl ester, (2E)-, methyl (2E)-[2-(2-chlorophenyl)hydrazinylidene][(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethanoate
| Molecular Formula | C16H13ClN6O2S |
|---|---|
| Molecular Weight | 388.05 g/mol |
| LogP | 3.0064 |
| Topological Polar Surface Area | 94.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.05093 |
| Heavy Atoms | 26 |
| Complexity | 931.2541 |
Chemical Identifiers
| CAS Number | 669760-68-3 |
|---|---|
| SMILES | COC(=O)/C(=N\NC1=CC=CC=C1Cl)/SC2=NN=NN2C3=CC=CC=C3 |
Product Overview
(E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate (CAS 669760-68-3), with molecular formula C16H13ClN6O2S and molecular weight 388.05 g/mol. IUPAC: methyl (2E)-2-[(2-chlorophenyl)hydrazinylidene]-2-(1-phenyltetrazol-5-yl)sulfanylacetate.
Chemical Property Profile of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate
Property Insights of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate
The XLogP value of 3.0064 indicates that (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate. Following Lipinski's Rule of Five, (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate has 1 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 (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate?
The CAS number of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate is 669760-68-3.
What is the molecular formula of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate?
The molecular formula of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate is C16H13ClN6O2S.
What is the molecular weight of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate?
The molecular weight of (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate is 388.05 g/mol.
Where can I buy (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate?
You can request a quote for (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 2-(2-(2-chlorophenyl)hydrazono)-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.