![Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate structure](/static/products/1026/1026104-65-3.webp)
Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate
TL;DR: Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate (CAS 1026104-65-3) is a chemical compound with molecular formula C11H14F3N3O3 and molecular weight 293.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate
Also Known As: methyl 2-{[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]formamido}butanoate, Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate, methyl 2-({[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]carbonyl}amino)butanoate, 8T-0290
| Molecular Formula | C11H14F3N3O3 |
|---|---|
| Molecular Weight | 293.10 g/mol |
| LogP | 1.1203 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.09872 |
| Heavy Atoms | 20 |
| Complexity | 510.747 |
Chemical Identifiers
| CAS Number | 1026104-65-3 |
|---|---|
| SMILES | CCC(C(=O)OC)NC(=O)C1=CN(N=C1C(F)(F)F)C |
Product Overview
Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate (CAS 1026104-65-3), with molecular formula C11H14F3N3O3 and molecular weight 293.10 g/mol. IUPAC: methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate.
Chemical Property Profile of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate
Property Insights of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate
The XLogP value of 1.1203 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate. Following Lipinski's Rule of Five, Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate has 1 hydrogen bond donor(s) and 4 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 Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate?
The CAS number of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate is 1026104-65-3.
What is the molecular formula of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate?
The molecular formula of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate is C11H14F3N3O3.
What is the molecular weight of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate?
The molecular weight of Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate is 293.10 g/mol.
Where can I buy Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate?
You can request a quote for Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl]amino]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.