![N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide structure](/static/products/713/713083-33-1.png)
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide
TL;DR: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide (CAS 713083-33-1) is a chemical compound with molecular formula C22H31N5O2S and molecular weight 429.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-[4-(2-phenylethyl)piperazin-1-yl]butanamide
Also Known As: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide, N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide, N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4-[4-(2-phenylethyl)piperazin-1-yl]butanamide
| Molecular Formula | C22H31N5O2S |
|---|---|
| Molecular Weight | 429.22 g/mol |
| LogP | 2.8422 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 429.21985 |
| Heavy Atoms | 30 |
| Complexity | 815.9452 |
Chemical Identifiers
| CAS Number | 713083-33-1 |
|---|---|
| SMILES | CC(C)CC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)CCC3=CC=CC=C3 |
Product Overview
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide (CAS 713083-33-1), with molecular formula C22H31N5O2S and molecular weight 429.22 g/mol. IUPAC: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-[4-(2-phenylethyl)piperazin-1-yl]butanamide.
Chemical Property Profile of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide
Property Insights of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide
The XLogP value of 2.8422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide. Following Lipinski's Rule of Five, N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide has 1 hydrogen bond donor(s) and 6 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-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide?
The CAS number of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide is 713083-33-1.
What is the molecular formula of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide?
The molecular formula of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide is C22H31N5O2S.
What is the molecular weight of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide?
The molecular weight of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide is 429.22 g/mol.
Where can I buy N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide?
You can request a quote for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4-(4-phenethylpiperazin-1-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.