N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide
TL;DR: N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide (CAS 893159-11-0) is a chemical compound with molecular formula C13H15N3OS2 and molecular weight 293.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide
Also Known As: N-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide, F1838-1838, N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide, N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide, N~1~-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
| Molecular Formula | C13H15N3OS2 |
|---|---|
| Molecular Weight | 293.07 g/mol |
| LogP | 3.48732 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.06564 |
| Heavy Atoms | 19 |
| Complexity | 551.2709 |
Chemical Identifiers
| CAS Number | 893159-11-0 |
|---|---|
| SMILES | CCC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)C |
Product Overview
N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide (CAS 893159-11-0), with molecular formula C13H15N3OS2 and molecular weight 293.07 g/mol. IUPAC: N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide.
Chemical Property Profile of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide
Property Insights of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide
The XLogP value of 3.48732 indicates that N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide 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-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide 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-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide?
The CAS number of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide is 893159-11-0.
What is the molecular formula of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide?
The molecular formula of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide is C13H15N3OS2.
What is the molecular weight of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide?
The molecular weight of N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide is 293.07 g/mol.
Where can I buy N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide?
You can request a quote for N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-((4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.