2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine
TL;DR: 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine (CAS 1049740-35-3) is a chemical compound with molecular formula C20H20ClF3N4O and molecular weight 424.12778 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-benzylpiperazin-1-yl)-4-(furan-2-yl)-6-(trifluoromethyl)pyrimidine;hydrochloride
Also Known As: 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine, 2-(4-BENZYLPIPERAZIN-1-YL)-4-(FURAN-2-YL)-6-(TRIFLUOROMETHYL)PYRIMIDINE HYDROCHLORIDE
Technical Specifications
| Molecular Formula | C20H20ClF3N4O |
| Molecular Weight | 424.12778 g/mol |
| XLogP | 4.4994 |
| Topological Polar Surface Area (TPSA) | 45.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.12778 Da |
| Heavy Atoms | 29 |
| Complexity | 492.0 |
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=NC(=CC(=N3)C(F)(F)F)C4=CC=CO4.Cl |
| InChIKey | LWNNPEOUXWADOO-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine
Property Insights of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine
The XLogP value of 4.4994 indicates that 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.4 Ų, 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine?
The CAS number of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine is 1049740-35-3.
What is the molecular formula of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine?
The molecular formula of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine is C20H20ClF3N4O.
What is the molecular weight of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine?
The molecular weight of 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine is 424.12778 g/mol.
Where can I buy 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine?
You can request a quote for 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine?
Yes, CoreyChem provides custom synthesis services for 2-(4-Benzyl-piperazin-1-yl)-4-furan-2-yl-6-trifluoromethyl-pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.