![4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide structure](/static/products/714/714244-03-8.png)
4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
TL;DR: 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide (CAS 714244-03-8) is a chemical compound with molecular formula C23H33N5O3S and molecular weight 459.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
Also Known As: 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide, 4-{4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl}-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide, N-(5-Isobutyl-[1,3,4]thiadiazol-2-yl)-4-oxo-4-[4-(2-p-tolyloxy-ethyl)-piperazin-1-yl]-butyramide, N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)butanamide
| Molecular Formula | C23H33N5O3S |
|---|---|
| Molecular Weight | 459.23 g/mol |
| LogP | 2.98692 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 459.2304 |
| Heavy Atoms | 32 |
| Complexity | 876.01196 |
Chemical Identifiers
| CAS Number | 714244-03-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)CC(C)C |
Product Overview
4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide (CAS 714244-03-8), with molecular formula C23H33N5O3S and molecular weight 459.23 g/mol. IUPAC: 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide.
Chemical Property Profile of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
Property Insights of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
The XLogP value of 2.98692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide. The TPSA of 87.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide. Following Lipinski's Rule of Five, 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide has 1 hydrogen bond donor(s) and 7 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 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide?
The CAS number of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide is 714244-03-8.
What is the molecular formula of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide?
The molecular formula of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide is C23H33N5O3S.
What is the molecular weight of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide?
The molecular weight of 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide is 459.23 g/mol.
Where can I buy 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide?
You can request a quote for 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.