5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
TL;DR: 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione (CAS 15020-67-4) is a chemical compound with molecular formula C15H15F3N2O2 and molecular weight 312.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
Also Known As: 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione, 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dion, 5-(4-Phenylbutyl)-6-(trifluoromethyl)pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C15H15F3N2O2 |
|---|---|
| Molecular Weight | 312.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.10855 |
| Heavy Atoms | 22 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 15020-67-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCCC2=C(NC(=O)NC2=O)C(F)(F)F |
| InChIKey | IHXCBAWTZYBRDV-UHFFFAOYSA-N |
Product Overview
5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione (CAS 15020-67-4), with molecular formula C15H15F3N2O2 and molecular weight 312.11 g/mol. IUPAC: 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
Property Insights of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
The XLogP value of 3.2 indicates that 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione has 2 hydrogen bond donor(s) and 5 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 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione?
The CAS number of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione is 15020-67-4.
What is the molecular formula of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione?
The molecular formula of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione is C15H15F3N2O2.
What is the molecular weight of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione?
The molecular weight of 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione is 312.11 g/mol.
Where can I buy 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione?
You can request a quote for 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-phenylbutyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.