![methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate structure](/static/products/339/339995-10-7.png)
methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate
TL;DR: methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate (CAS 339995-10-7) is a chemical compound with molecular formula C18H15N3O3S2 and molecular weight 385.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]benzoate
Also Known As: A1450/0064089, (E)-methyl 4-((2-(2-(benzo[d]thiazol-2-ylthio)acetyl)hydrazono)methyl)benzoate, methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate, methyl 4-((E)-{[(1,3-benzothiazol-2-ylthio)acetyl]hydrazono}methyl)benzoate, methyl 4-[(E)-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]benzoate
| Molecular Formula | C18H15N3O3S2 |
|---|---|
| Molecular Weight | 385.06 g/mol |
| LogP | 3.3253 |
| Topological Polar Surface Area | 80.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.05548 |
| Heavy Atoms | 26 |
| Complexity | 918.72955 |
Chemical Identifiers
| CAS Number | 339995-10-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2 |
Product Overview
methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate (CAS 339995-10-7), with molecular formula C18H15N3O3S2 and molecular weight 385.06 g/mol. IUPAC: methyl 4-[(E)-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]benzoate.
Chemical Property Profile of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate
Property Insights of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate
The XLogP value of 3.3253 indicates that methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.65 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate. Following Lipinski's Rule of Five, methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate has 1 hydrogen bond donor(s) and 7 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 methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate?
The CAS number of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate is 339995-10-7.
What is the molecular formula of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate?
The molecular formula of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate is C18H15N3O3S2.
What is the molecular weight of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate?
The molecular weight of methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate is 385.06 g/mol.
Where can I buy methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate?
You can request a quote for methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-((E)-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazono}methyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.