4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate
TL;DR: 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate (CAS 303107-39-3) is a chemical compound with molecular formula C19H17N3O4S2 and molecular weight 415.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate
Also Known As: 4-(2-((1,3-BENZOTHIAZOL-2-YLTHIO)AC)CARBOHYDRAZONOYL)-2-METHOXYPHENYL ACETATE, 4-[(E)-{2-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl acetate, (E)-4-((2-(2-(benzo[d]thiazol-2-ylthio)acetyl)hydrazono)methyl)-2-methoxyphenyl acetate, 4-[(1E)-2-(2-benzothiazol-2-ylthioacetylamino)-2-azavinyl]-2-methoxyphenyl ace tate, [4-[(E)-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate
| Molecular Formula | C19H17N3O4S2 |
|---|---|
| Molecular Weight | 415.07 g/mol |
| LogP | 3.4726 |
| Topological Polar Surface Area | 89.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.06604 |
| Heavy Atoms | 28 |
| Complexity | 999.94556 |
Chemical Identifiers
| CAS Number | 303107-39-3 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2)OC |
Product Overview
4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate (CAS 303107-39-3), with molecular formula C19H17N3O4S2 and molecular weight 415.07 g/mol. IUPAC: [4-[(E)-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate.
Chemical Property Profile of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate
Property Insights of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate
The XLogP value of 3.4726 indicates that 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate. Following Lipinski's Rule of Five, 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl 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 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate?
The CAS number of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate is 303107-39-3.
What is the molecular formula of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate?
The molecular formula of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate is C19H17N3O4S2.
What is the molecular weight of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate?
The molecular weight of 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate is 415.07 g/mol.
Where can I buy 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate?
You can request a quote for 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-((1,3-Benzothiazol-2-ylthio)AC)carbohydrazonoyl)-2-methoxyphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.