3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one
TL;DR: 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one (CAS 1004020-66-9) is a chemical compound with molecular formula C8H10N4OS and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dimethylpyrazol-4-yl)-2-sulfanylideneimidazolidin-4-one
Also Known As: 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one, 3-(1,3-Dimethyl-1H-pyrazol-4-yl)-2-thioxo-imidazolidin-4-one, 3-(1,3-dimethylpyrazol-4-yl)-2-sulfanylideneimidazolidin-4-one, 3-(1,3-dimethylpyrazol-4-yl)-2-thioxo-imidazolidin-4-one, 3-(1,3-dimethyl-1h-pyrazol-4-yl)-2-thioxo-4-imidazolidinone
| Molecular Formula | C8H10N4OS |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | -0.05038 |
| Topological Polar Surface Area | 50.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.05753 |
| Heavy Atoms | 14 |
| Complexity | 395.47382 |
Chemical Identifiers
| CAS Number | 1004020-66-9 |
|---|---|
| SMILES | CC1=NN(C=C1N2C(=O)CNC2=S)C |
Product Overview
3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one (CAS 1004020-66-9), with molecular formula C8H10N4OS and molecular weight 210.06 g/mol. IUPAC: 3-(1,3-dimethylpyrazol-4-yl)-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one
Property Insights of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one
The XLogP value of -0.05038 indicates that 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.16 Ų, 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one has 1 hydrogen bond donor(s) and 3 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 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one?
The CAS number of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one is 1004020-66-9.
What is the molecular formula of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one?
The molecular formula of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one is C8H10N4OS.
What is the molecular weight of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one?
The molecular weight of 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one is 210.06 g/mol.
Where can I buy 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one?
You can request a quote for 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.