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 210.05753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Technical Specifications
| Molecular Formula | C8H10N4OS |
| Molecular Weight | 210.05753 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 82.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.05753 Da |
| Heavy Atoms | 14 |
| Complexity | 283.0 |
| SMILES | CC1=NN(C=C1N2C(=O)CNC2=S)C |
| InChIKey | VBYCQDDSZAJOIR-UHFFFAOYSA-N |
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 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one. 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
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 210.05753 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 CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1,3-dimethyl-1H-pyrazol-4-yl)-2-thioxoimidazolidin-4-one?
Yes, CoreyChem 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.