1-Piperazinecarbothioamide
TL;DR: 1-Piperazinecarbothioamide (CAS 54147-49-8) is a chemical compound with molecular formula C5H11N3S and molecular weight 145.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
piperazine-1-carbothioamide
Also Known As: Piperazine-1-carbothioamide, 1-piperazinecarbothioamide, 1-piperazinyl-thiocarboxamide, aminopiperazinylmethane-1-thione, 1-Piperazinecarbothioamide(9CI)
| Molecular Formula | C5H11N3S |
|---|---|
| Molecular Weight | 145.07 g/mol |
| LogP | -0.8648 |
| Topological Polar Surface Area | 41.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 145.06737 |
| Heavy Atoms | 9 |
| Complexity | 108.77074 |
Chemical Identifiers
| CAS Number | 54147-49-8 |
|---|---|
| SMILES | C1CN(CCN1)C(=S)N |
Product Overview
1-Piperazinecarbothioamide (CAS 54147-49-8), with molecular formula C5H11N3S and molecular weight 145.07 g/mol. IUPAC: piperazine-1-carbothioamide.
Chemical Property Profile of 1-Piperazinecarbothioamide
Property Insights of 1-Piperazinecarbothioamide
The XLogP value of -0.8648 indicates that 1-Piperazinecarbothioamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.29 Ų, 1-Piperazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinecarbothioamide has 2 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-Piperazinecarbothioamide?
The CAS number of 1-Piperazinecarbothioamide is 54147-49-8.
What is the molecular formula of 1-Piperazinecarbothioamide?
The molecular formula of 1-Piperazinecarbothioamide is C5H11N3S.
What is the molecular weight of 1-Piperazinecarbothioamide?
The molecular weight of 1-Piperazinecarbothioamide is 145.07 g/mol.
Where can I buy 1-Piperazinecarbothioamide?
You can request a quote for 1-Piperazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.