![1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea structure](/static/products/5128/512822-90-1.webp)
1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea
TL;DR: 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea (CAS 512822-90-1) is a chemical compound with molecular formula C9H12F3N5OS and molecular weight 295.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-3-[[1-methyl-3-(trifluoromethyl)pyrazole-5-carbonyl]amino]thiourea
Also Known As: 1-ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea, N-ethyl-2-{[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]carbonyl}hydrazinecarbothioamide, N-ETHYL-2-{[1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-5-YL]CARBONYL}-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C9H12F3N5OS |
|---|---|
| Molecular Weight | 295.07 g/mol |
| LogP | 0.5677 |
| Topological Polar Surface Area | 70.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.07147 |
| Heavy Atoms | 19 |
| Complexity | 484.6899 |
Chemical Identifiers
| CAS Number | 512822-90-1 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)C1=CC(=NN1C)C(F)(F)F |
Product Overview
1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea (CAS 512822-90-1), with molecular formula C9H12F3N5OS and molecular weight 295.07 g/mol. IUPAC: 1-ethyl-3-[[1-methyl-3-(trifluoromethyl)pyrazole-5-carbonyl]amino]thiourea.
Chemical Property Profile of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea
Property Insights of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea
The XLogP value of 0.5677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea. The TPSA of 70.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea. Following Lipinski's Rule of Five, 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea has 3 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 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea?
The CAS number of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea is 512822-90-1.
What is the molecular formula of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea?
The molecular formula of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea is C9H12F3N5OS.
What is the molecular weight of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea?
The molecular weight of 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea is 295.07 g/mol.
Where can I buy 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea?
You can request a quote for 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-3-[[2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.