![3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide structure](/static/products/1037/1037719-44-0.webp)
3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide
TL;DR: 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide (CAS 1037719-44-0) is a chemical compound with molecular formula C11H9Cl2N5OS and molecular weight 328.99048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(3,4-dichlorophenyl)carbamothioylamino]-1H-pyrazole-4-carboxamide
Also Known As: 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide, 3-({[(3,4-dichlorophenyl)amino]thioxomethyl}amino)pyrazole-4-carboxamide, 3-[(3,4-dichlorophenyl)thiocarbamoylamino]-2H-pyrazole-4-carboxamide, 3-{[(3,4-Dichlorophenyl)carbamothioyl]amino}-1H-pyrazole-4-carboxamide, 5-[(3,4-dichlorophenyl)carbamothioylamino]-1H-pyrazole-4-carboxamide
Technical Specifications
| Molecular Formula | C11H9Cl2N5OS |
| Molecular Weight | 328.99048 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.99048 Da |
| Heavy Atoms | 20 |
| Complexity | 386.0 |
| SMILES | C1=CC(=C(C=C1NC(=S)NC2=C(C=NN2)C(=O)N)Cl)Cl |
| InChIKey | PLNPPPAZAHISLB-UHFFFAOYSA-N |
Chemical Property Profile of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide
Property Insights of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide. Following Lipinski's Rule of Five, 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide has 4 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-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide?
The CAS number of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide is 1037719-44-0.
What is the molecular formula of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide?
The molecular formula of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide is C11H9Cl2N5OS.
What is the molecular weight of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide?
The molecular weight of 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide is 328.99048 g/mol.
Where can I buy 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide?
You can request a quote for 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide?
Yes, CoreyChem provides custom synthesis services for 3-[[[(3,4-Dichlorophenyl)amino]thioxomethyl]amino]-1H-pyrazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.