4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
TL;DR: 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide (CAS 714931-07-4) is a chemical compound with molecular formula C19H27N7O2S and molecular weight 417.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
Also Known As: 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide, 4-[4-(4,6-Dimethyl-pyrimidin-2-yl)-piperazin-1-yl]-4-oxo-N-(5-propyl-[1,3,4]thiadiazol-2-yl)-butyramide, 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide, 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
| Molecular Formula | C19H27N7O2S |
|---|---|
| Molecular Weight | 417.19 g/mol |
| LogP | 1.96494 |
| Topological Polar Surface Area | 104.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.1947 |
| Heavy Atoms | 29 |
| Complexity | 841.7426 |
Chemical Identifiers
| CAS Number | 714931-07-4 |
|---|---|
| SMILES | CCCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NC(=CC(=N3)C)C |
Product Overview
4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide (CAS 714931-07-4), with molecular formula C19H27N7O2S and molecular weight 417.19 g/mol. IUPAC: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide.
Chemical Property Profile of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
Property Insights of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide
The XLogP value of 1.96494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide. The TPSA of 104.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide. Following Lipinski's Rule of Five, 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide has 1 hydrogen bond donor(s) and 8 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-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide?
The CAS number of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide is 714931-07-4.
What is the molecular formula of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide?
The molecular formula of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide is C19H27N7O2S.
What is the molecular weight of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide?
The molecular weight of 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide is 417.19 g/mol.
Where can I buy 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide?
You can request a quote for 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl)-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.