N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide
TL;DR: N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide (CAS 893156-81-5) is a chemical compound with molecular formula C12H13N3OS2 and molecular weight 279.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide, F1838-1785, N-(5-{[(2-METHYLPHENYL)METHYL]SULFANYL}-1,3,4-THIADIAZOL-2-YL)ACETAMIDE, N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C12H13N3OS2 |
|---|---|
| Molecular Weight | 279.05 g/mol |
| LogP | 3.09722 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.05002 |
| Heavy Atoms | 18 |
| Complexity | 553.7605 |
Chemical Identifiers
| CAS Number | 893156-81-5 |
|---|---|
| SMILES | CC1=CC=CC=C1CSC2=NN=C(S2)NC(=O)C |
Product Overview
N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide (CAS 893156-81-5), with molecular formula C12H13N3OS2 and molecular weight 279.05 g/mol. IUPAC: N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide
Property Insights of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide
The XLogP value of 3.09722 indicates that N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide has 1 hydrogen bond donor(s) and 5 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-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide?
The CAS number of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide is 893156-81-5.
What is the molecular formula of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide?
The molecular formula of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide is C12H13N3OS2.
What is the molecular weight of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide?
The molecular weight of N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide is 279.05 g/mol.
Where can I buy N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide?
You can request a quote for N-(5-((2-methylbenzyl)thio)-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-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-((2-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.