1-Acetyl-4-thioformylpiperazine
TL;DR: 1-Acetyl-4-thioformylpiperazine (CAS 130317-92-9) is a chemical compound with molecular formula C7H12N2OS and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetylpiperazine-1-carbothialdehyde
Also Known As: 1-Acetyl-4-thioformylpiperazine, 4-acetylpiperazine-1-carbothialdehyde, 4-Acetyl-1-piperazinecarbothialdehyde, 1-Piperazinecarbothioaldehyde,4-acetyl-(9CI), NCI60_010858
| Molecular Formula | C7H12N2OS |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.06703 |
| Heavy Atoms | 11 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 130317-92-9 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C=S |
| InChIKey | IYBAADNGQMARBG-UHFFFAOYSA-N |
Product Overview
1-Acetyl-4-thioformylpiperazine (CAS 130317-92-9), with molecular formula C7H12N2OS and molecular weight 172.07 g/mol. IUPAC: 4-acetylpiperazine-1-carbothialdehyde.
Chemical Property Profile of 1-Acetyl-4-thioformylpiperazine
Property Insights of 1-Acetyl-4-thioformylpiperazine
The XLogP value of -0.4 indicates that 1-Acetyl-4-thioformylpiperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.6 Ų, 1-Acetyl-4-thioformylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetyl-4-thioformylpiperazine has 0 hydrogen bond donor(s) and 2 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 1-Acetyl-4-thioformylpiperazine?
The CAS number of 1-Acetyl-4-thioformylpiperazine is 130317-92-9.
What is the molecular formula of 1-Acetyl-4-thioformylpiperazine?
The molecular formula of 1-Acetyl-4-thioformylpiperazine is C7H12N2OS.
What is the molecular weight of 1-Acetyl-4-thioformylpiperazine?
The molecular weight of 1-Acetyl-4-thioformylpiperazine is 172.07 g/mol.
Where can I buy 1-Acetyl-4-thioformylpiperazine?
You can request a quote for 1-Acetyl-4-thioformylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-4-thioformylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-4-thioformylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.