![N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide structure](/static/products/313/313531-95-2.png)
N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
TL;DR: N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide (CAS 313531-95-2) is a chemical compound with molecular formula C7H11N3OS and molecular weight 185.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: BAS 00321608, N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide, n-(5-isopropyl-1,3,4-thiadiazol-2-yl)acetamide, N-(5-Isopropyl-[1,3,4]thiadiazol-2-yl)-acetamide, Acetamide, N-[5-(1-methylethyl)-1,3,4-thiadiazol-2-yl]-
| Molecular Formula | C7H11N3OS |
|---|---|
| Molecular Weight | 185.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.06229 |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 313531-95-2 |
|---|---|
| SMILES | CC(C)C1=NN=C(S1)NC(=O)C |
| InChIKey | SGJHXDLGJXQMQQ-UHFFFAOYSA-N |
Product Overview
N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide (CAS 313531-95-2), with molecular formula C7H11N3OS and molecular weight 185.06 g/mol. IUPAC: N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide.
Chemical Property Profile of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Property Insights of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide. Following Lipinski's Rule of Five, N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide has 1 hydrogen bond donor(s) and 4 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-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide?
The CAS number of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide is 313531-95-2.
What is the molecular formula of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide?
The molecular formula of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide is C7H11N3OS.
What is the molecular weight of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide?
The molecular weight of N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide is 185.06 g/mol.
Where can I buy N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide?
You can request a quote for N-[5-(propan-2-yl)-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-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.