Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate
TL;DR: Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate (CAS 677706-89-7) is a chemical compound with molecular formula C12H14F3N3O3 and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate
Also Known As: starbld0013025, ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate, ethyl 2-(morpholin-4-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate, ETHYL2-MORPHOLINO-4- PYRIMIDINE-5-CARBOXYLATE, ethyl 2-morpholino-4-(trifluoromethyl)pyrimidine-5-carboxylate
| Molecular Formula | C12H14F3N3O3 |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 1.5087 |
| Topological Polar Surface Area | 64.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.09872 |
| Heavy Atoms | 21 |
| Complexity | 516.20447 |
Chemical Identifiers
| CAS Number | 677706-89-7 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1C(F)(F)F)N2CCOCC2 |
Product Overview
Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate (CAS 677706-89-7), with molecular formula C12H14F3N3O3 and molecular weight 305.10 g/mol. IUPAC: ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate
Property Insights of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate
The XLogP value of 1.5087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate. The TPSA of 64.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate has 0 hydrogen bond donor(s) and 6 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 Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate?
The CAS number of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate is 677706-89-7.
What is the molecular formula of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate?
The molecular formula of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate is C12H14F3N3O3.
What is the molecular weight of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate?
The molecular weight of Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate is 305.10 g/mol.
Where can I buy Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate?
You can request a quote for Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-morpholin-4-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.