![2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate structure](/static/products/3013/301331-17-9.webp)
2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate
TL;DR: 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate (CAS 301331-17-9) is a chemical compound with molecular formula C18H21F3N2O3 and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 3,4-dimethyl-2-oxo-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate
Also Known As: 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate, 2-methylpropyl 3,4-dimethyl-2-oxo-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate, isobutyl 1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
| Molecular Formula | C18H21F3N2O3 |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 3.8747 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.15042 |
| Heavy Atoms | 26 |
| Complexity | 741.442 |
Chemical Identifiers
| CAS Number | 301331-17-9 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC=CC=C2C(F)(F)F)C(=O)OCC(C)C |
Product Overview
2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate (CAS 301331-17-9), with molecular formula C18H21F3N2O3 and molecular weight 370.15 g/mol. IUPAC: 2-methylpropyl 3,4-dimethyl-2-oxo-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate
Property Insights of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate
The XLogP value of 3.8747 indicates that 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate has 1 hydrogen bond donor(s) and 3 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-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate?
The CAS number of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate is 301331-17-9.
What is the molecular formula of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate?
The molecular formula of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate is C18H21F3N2O3.
What is the molecular weight of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate?
The molecular weight of 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate is 370.15 g/mol.
Where can I buy 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate?
You can request a quote for 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylpropyl 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.