4-Cyclopropyl-5-thioxopyrazolidin-3-one
TL;DR: 4-Cyclopropyl-5-thioxopyrazolidin-3-one (CAS 565179-45-5) is a chemical compound with molecular formula C6H8N2OS and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyclopropyl-5-sulfanylidenepyrazolidin-3-one
Also Known As: 4-Cyclopropyl-5-thioxopyrazolidin-3-one, 4-Cyclopropyl-5-thioxo-3-pyrazolidinone, 4-cyclopropyl-5-sulfanylidenepyrazolidin-3-one, 3-Pyrazolidinone, 4-cyclopropyl-5-thioxo- (9CI)
| Molecular Formula | C6H8N2OS |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | -0.0256 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.03574 |
| Heavy Atoms | 10 |
| Complexity | 183.9245 |
Chemical Identifiers
| CAS Number | 565179-45-5 |
|---|---|
| SMILES | C1CC1C2C(=O)NNC2=S |
Product Overview
4-Cyclopropyl-5-thioxopyrazolidin-3-one (CAS 565179-45-5), with molecular formula C6H8N2OS and molecular weight 156.04 g/mol. IUPAC: 4-cyclopropyl-5-sulfanylidenepyrazolidin-3-one.
Chemical Property Profile of 4-Cyclopropyl-5-thioxopyrazolidin-3-one
Property Insights of 4-Cyclopropyl-5-thioxopyrazolidin-3-one
The XLogP value of -0.0256 indicates that 4-Cyclopropyl-5-thioxopyrazolidin-3-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.13 Ų, 4-Cyclopropyl-5-thioxopyrazolidin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Cyclopropyl-5-thioxopyrazolidin-3-one 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 4-Cyclopropyl-5-thioxopyrazolidin-3-one?
The CAS number of 4-Cyclopropyl-5-thioxopyrazolidin-3-one is 565179-45-5.
What is the molecular formula of 4-Cyclopropyl-5-thioxopyrazolidin-3-one?
The molecular formula of 4-Cyclopropyl-5-thioxopyrazolidin-3-one is C6H8N2OS.
What is the molecular weight of 4-Cyclopropyl-5-thioxopyrazolidin-3-one?
The molecular weight of 4-Cyclopropyl-5-thioxopyrazolidin-3-one is 156.04 g/mol.
Where can I buy 4-Cyclopropyl-5-thioxopyrazolidin-3-one?
You can request a quote for 4-Cyclopropyl-5-thioxopyrazolidin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyclopropyl-5-thioxopyrazolidin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyclopropyl-5-thioxopyrazolidin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.