N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide
TL;DR: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide (CAS 438475-52-6) is a chemical compound with molecular formula C12H21N3OS2 and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide
Also Known As: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide, N-(5-ethylthio-1,3,4-thiadiazol-2-yl)octanamide, N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]octanamide, N~1~-[5-(ETHYLSULFANYL)-1,3,4-THIADIAZOL-2-YL]OCTANAMIDE
| Molecular Formula | C12H21N3OS2 |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 3.9491 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 287.1126 |
| Heavy Atoms | 18 |
| Complexity | 354.84665 |
Chemical Identifiers
| CAS Number | 438475-52-6 |
|---|---|
| SMILES | CCCCCCCC(=O)NC1=NN=C(S1)SCC |
Product Overview
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide (CAS 438475-52-6), with molecular formula C12H21N3OS2 and molecular weight 287.11 g/mol. IUPAC: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide.
Chemical Property Profile of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide
Property Insights of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide
The XLogP value of 3.9491 indicates that N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide 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-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide 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-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide?
The CAS number of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide is 438475-52-6.
What is the molecular formula of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide?
The molecular formula of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide is C12H21N3OS2.
What is the molecular weight of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide?
The molecular weight of N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide is 287.11 g/mol.
Where can I buy N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide?
You can request a quote for N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)octanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.