![N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide structure](/static/products/864/864918-68-3.png)
N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
TL;DR: N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide (CAS 864918-68-3) 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.
N-(1,3-benzodioxol-5-yl)-2-[[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl]acetamide
Also Known As: N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide, N-(benzo[d][1,3]dioxol-5-yl)-2-((3-(o-tolyl)-1,2,4-thiadiazol-5-yl)thio)acetamide, N-(1,3-benzodioxol-5-yl)-2-[[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl]acetamide, N-(2H-1,3-benzodioxol-5-yl)[3-(o-tolyl)-1,2,4-thiadiazol-5-ylthio]acetamide
| Molecular Formula | C18H15N3O3S2 |
|---|---|
| Molecular Weight | 385.06 g/mol |
| LogP | 3.97302 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.05548 |
| Heavy Atoms | 26 |
| Complexity | 958.3593 |
Chemical Identifiers
| CAS Number | 864918-68-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NSC(=N2)SCC(=O)NC3=CC4=C(C=C3)OCO4 |
Product Overview
N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide (CAS 864918-68-3), with molecular formula C18H15N3O3S2 and molecular weight 385.06 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl]acetamide.
Chemical Property Profile of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
Property Insights of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
The XLogP value of 3.97302 indicates that N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide. Following Lipinski's Rule of Five, N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide 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 N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide?
The CAS number of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide is 864918-68-3.
What is the molecular formula of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide?
The molecular formula of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide is C18H15N3O3S2.
What is the molecular weight of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide?
The molecular weight of N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide is 385.06 g/mol.
Where can I buy N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide?
You can request a quote for N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methylphenyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.