![N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide structure](/static/products/3296/329689-24-9.webp)
N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
TL;DR: N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide (CAS 329689-24-9) is a chemical compound with molecular formula C13H13N3O4S and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-acetyl-2-(1,3-benzodioxol-5-yl)-2H-1,3,4-thiadiazol-5-yl]acetamide
Also Known As: N-[4-acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide, N-(4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide, N-[3-acetyl-2-(1,3-benzodioxol-5-yl)-2H-1,3,4-thiadiazol-5-yl]acetamide, N-[4-Acetyl-5-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide, N-[4-ACETYL-5-(2H-1,3-BENZODIOXOL-5-YL)-5H-1,3,4-THIADIAZOL-2-YL]ACETAMIDE
| Molecular Formula | C13H13N3O4S |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 1.4163 |
| Topological Polar Surface Area | 80.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.06268 |
| Heavy Atoms | 21 |
| Complexity | 646.3036 |
Chemical Identifiers
| CAS Number | 329689-24-9 |
|---|---|
| SMILES | CC(=O)NC1=NN(C(S1)C2=CC3=C(C=C2)OCO3)C(=O)C |
Product Overview
N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide (CAS 329689-24-9), with molecular formula C13H13N3O4S and molecular weight 307.06 g/mol. IUPAC: N-[3-acetyl-2-(1,3-benzodioxol-5-yl)-2H-1,3,4-thiadiazol-5-yl]acetamide.
Chemical Property Profile of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
Property Insights of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
The XLogP value of 1.4163 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide. The TPSA of 80.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide. Following Lipinski's Rule of Five, N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide has 1 hydrogen bond donor(s) and 6 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-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide?
The CAS number of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide is 329689-24-9.
What is the molecular formula of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide?
The molecular formula of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide is C13H13N3O4S.
What is the molecular weight of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide?
The molecular weight of N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide is 307.06 g/mol.
Where can I buy N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide?
You can request a quote for N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-Acetyl-5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.