N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide
TL;DR: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide (CAS 35588-53-5) is a chemical compound with molecular formula C8H12ClN3OS and molecular weight 233.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide
Also Known As: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide, N-(5-tert-Butyl-[1,3,4]thiadiazol-2-yl)-2-chloro-acetamide, BAS 01949401, N-(5-(tert-Butyl)-1,3,4-thiadiazol-2-yl)-2-chloroacetamide, (4-methylsulfanylphenyl)hydrazine Hydrochloride
| Molecular Formula | C8H12ClN3OS |
|---|---|
| Molecular Weight | 233.04 g/mol |
| LogP | 2.0129 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.03896 |
| Heavy Atoms | 14 |
| Complexity | 331.57254 |
Chemical Identifiers
| CAS Number | 35588-53-5 |
|---|---|
| SMILES | CC(C)(C)C1=NN=C(S1)NC(=O)CCl |
Product Overview
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide (CAS 35588-53-5), with molecular formula C8H12ClN3OS and molecular weight 233.04 g/mol. IUPAC: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide.
Chemical Property Profile of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide
Property Insights of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide
The XLogP value of 2.0129 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide 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-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide?
The CAS number of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide is 35588-53-5.
What is the molecular formula of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide?
The molecular formula of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide is C8H12ClN3OS.
What is the molecular weight of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide?
The molecular weight of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide is 233.04 g/mol.
Where can I buy N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide?
You can request a quote for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.