1H-Pyrazole-1-carbothioamide
TL;DR: 1H-Pyrazole-1-carbothioamide (CAS 1794-34-9) is a chemical compound with molecular formula C4H5N3S and molecular weight 127.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrazole-1-carbothioamide
Also Known As: 1H-Pyrazole-1-carbothioamide, Thiocarzolamide, pyrazole-1-carbothioamide, 1-thiocarbamoylpyrazole, Pyrazole-1-thiocarboxamide
| Molecular Formula | C4H5N3S |
|---|---|
| Molecular Weight | 127.02 g/mol |
| LogP | -0.0252 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.02042 |
| Heavy Atoms | 8 |
| Complexity | 179.17331 |
Chemical Identifiers
| CAS Number | 1794-34-9 |
|---|---|
| SMILES | C1=CN(N=C1)C(=S)N |
Product Overview
1H-Pyrazole-1-carbothioamide (CAS 1794-34-9), with molecular formula C4H5N3S and molecular weight 127.02 g/mol. IUPAC: pyrazole-1-carbothioamide.
Chemical Property Profile of 1H-Pyrazole-1-carbothioamide
Property Insights of 1H-Pyrazole-1-carbothioamide
The XLogP value of -0.0252 indicates that 1H-Pyrazole-1-carbothioamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.84 Ų, 1H-Pyrazole-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole-1-carbothioamide has 1 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 1H-Pyrazole-1-carbothioamide?
The CAS number of 1H-Pyrazole-1-carbothioamide is 1794-34-9.
What is the molecular formula of 1H-Pyrazole-1-carbothioamide?
The molecular formula of 1H-Pyrazole-1-carbothioamide is C4H5N3S.
What is the molecular weight of 1H-Pyrazole-1-carbothioamide?
The molecular weight of 1H-Pyrazole-1-carbothioamide is 127.02 g/mol.
Where can I buy 1H-Pyrazole-1-carbothioamide?
You can request a quote for 1H-Pyrazole-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.