2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate
TL;DR: 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate (CAS 257625-01-7) is a chemical compound with molecular formula C12H10F3N3O3S and molecular weight 333.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl 4-methylthiadiazole-5-carboxylate
Also Known As: 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate, 2-[4-(trifluoromethyl)pyridin-2-yl]oxyethyl 4-methylthiadiazole-5-carboxylate, 2-([4-(TRIFLUOROMETHYL)-2-PYRIDYL]OXY)ETHYL 4-METHYL-1,2,3-THIADIAZOLE-5-CARBOXYLATE, 2-{[4-(trifluoromethyl)pyridin-2-yl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate, 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl4-methyl-1,2,3-thiadiazole-5-carboxylate
| Molecular Formula | C12H10F3N3O3S |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 2.49612 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.0395 |
| Heavy Atoms | 22 |
| Complexity | 660.30634 |
Chemical Identifiers
| CAS Number | 257625-01-7 |
|---|---|
| SMILES | CC1=C(SN=N1)C(=O)OCCOC2=NC=CC(=C2)C(F)(F)F |
Product Overview
2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate (CAS 257625-01-7), with molecular formula C12H10F3N3O3S and molecular weight 333.04 g/mol. IUPAC: 2-[[4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl 4-methylthiadiazole-5-carboxylate.
Chemical Property Profile of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate
Property Insights of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate
The XLogP value of 2.49612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate. Following Lipinski's Rule of Five, 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate has 0 hydrogen bond donor(s) and 7 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 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate?
The CAS number of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate is 257625-01-7.
What is the molecular formula of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate?
The molecular formula of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate is C12H10F3N3O3S.
What is the molecular weight of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate?
The molecular weight of 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate is 333.04 g/mol.
Where can I buy 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate?
You can request a quote for 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(trifluoromethyl)-2-pyridyl]oxy}ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.