![methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate structure](/static/products/6777/677704-91-5.webp)
methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate
TL;DR: methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate (CAS 677704-91-5) is a chemical compound with molecular formula C9H7F3N2O2S and molecular weight 264.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazole-5-carboxylate
Also Known As: Maybridge4_000872, IDI1_031454, methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate, methyl 1-methyl-3-(trifluoromethyl)thieno[2,3-c]pyrazole-5-carboxylate
| Molecular Formula | C9H7F3N2O2S |
|---|---|
| Molecular Weight | 264.02 g/mol |
| LogP | 2.4402 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.01804 |
| Heavy Atoms | 17 |
| Complexity | 584.823 |
Chemical Identifiers
| CAS Number | 677704-91-5 |
|---|---|
| SMILES | CN1C2=C(C=C(S2)C(=O)OC)C(=N1)C(F)(F)F |
Product Overview
methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate (CAS 677704-91-5), with molecular formula C9H7F3N2O2S and molecular weight 264.02 g/mol. IUPAC: methyl 1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazole-5-carboxylate.
Chemical Property Profile of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate
Property Insights of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate
The XLogP value of 2.4402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate. With a topological polar surface area (TPSA) of 44.12 Ų, methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate has 0 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 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate?
The CAS number of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate is 677704-91-5.
What is the molecular formula of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate?
The molecular formula of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate is C9H7F3N2O2S.
What is the molecular weight of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate?
The molecular weight of methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate is 264.02 g/mol.
Where can I buy methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate?
You can request a quote for methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.