N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide
TL;DR: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide (CAS 599164-06-4) is a chemical compound with molecular formula C12H21N3OS and molecular weight 255.14 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-ethylbutanamide
Also Known As: BAS 05601128, N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide, N-(5-tert-Butyl-[1,3,4]thiadiazol-2-yl)-2-ethyl-butyramide, N-[5-(tert-butyl)(1,3,4-thiadiazol-2-yl)]-2-ethylbutanamide
| Molecular Formula | C12H21N3OS |
|---|---|
| Molecular Weight | 255.14 g/mol |
| LogP | 3.2103 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.14053 |
| Heavy Atoms | 17 |
| Complexity | 377.34763 |
Chemical Identifiers
| CAS Number | 599164-06-4 |
|---|---|
| SMILES | CCC(CC)C(=O)NC1=NN=C(S1)C(C)(C)C |
Product Overview
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide (CAS 599164-06-4), with molecular formula C12H21N3OS and molecular weight 255.14 g/mol. IUPAC: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide.
Chemical Property Profile of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide
Property Insights of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide
The XLogP value of 3.2103 indicates that N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide 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-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide 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-ethylbutanamide 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-ethylbutanamide?
The CAS number of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide is 599164-06-4.
What is the molecular formula of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide?
The molecular formula of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide is C12H21N3OS.
What is the molecular weight of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide?
The molecular weight of N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide is 255.14 g/mol.
Where can I buy N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide?
You can request a quote for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide 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-ethylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-ethylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.