methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
TL;DR: methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate (CAS 500272-29-7) is a chemical compound with molecular formula C11H16F3N3O3 and molecular weight 295.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate
Also Known As: methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate, methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate
| Molecular Formula | C11H16F3N3O3 |
|---|---|
| Molecular Weight | 295.11 g/mol |
| LogP | 1.5644 |
| Topological Polar Surface Area | 63.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.11438 |
| Heavy Atoms | 20 |
| Complexity | 443.92963 |
Chemical Identifiers
| CAS Number | 500272-29-7 |
|---|---|
| SMILES | CCN(CC)C1=NC(N=C(O1)C)(C(=O)OC)C(F)(F)F |
Product Overview
methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate (CAS 500272-29-7), with molecular formula C11H16F3N3O3 and molecular weight 295.11 g/mol. IUPAC: methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate.
Chemical Property Profile of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
Property Insights of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
The XLogP value of 1.5644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate. The TPSA of 63.49 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate. Following Lipinski's Rule of Five, methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-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 methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate?
The CAS number of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate is 500272-29-7.
What is the molecular formula of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate?
The molecular formula of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate is C11H16F3N3O3.
What is the molecular weight of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate?
The molecular weight of methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate is 295.11 g/mol.
Where can I buy methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate?
You can request a quote for methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(diethylamino)-6-methyl-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.