N-benzyl-4,6-difluoropyrimidin-2-amine
TL;DR: N-benzyl-4,6-difluoropyrimidin-2-amine (CAS 130866-84-1) is a chemical compound with molecular formula C11H9F2N3 and molecular weight 221.07645 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-4,6-difluoropyrimidin-2-amine
Also Known As: N-benzyl-4,6-difluoropyrimidin-2-amine, 2-benzylamino-4,6-difluoropyrimidine, 2-Pyrimidinamine, 4,6-difluoro-N-(phenylmethyl)-, N-benzyl-N-(4,6-difluoro-2-pyrimidinyl)amine, AB00081617-01
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H9F2N3 |
| Molecular Weight | 221.07645 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 37.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.07645 Da |
| Heavy Atoms | 16 |
| Complexity | 199.0 |
| SMILES | C1=CC=C(C=C1)CNC2=NC(=CC(=N2)F)F |
| InChIKey | DEXFDWDQRUGQPH-UHFFFAOYSA-N |
Chemical Property Profile of N-benzyl-4,6-difluoropyrimidin-2-amine
Property Insights of N-benzyl-4,6-difluoropyrimidin-2-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-4,6-difluoropyrimidin-2-amine. With a topological polar surface area (TPSA) of 37.8 Ų, N-benzyl-4,6-difluoropyrimidin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-4,6-difluoropyrimidin-2-amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-benzyl-4,6-difluoropyrimidin-2-amine?
The CAS number of N-benzyl-4,6-difluoropyrimidin-2-amine is 130866-84-1.
What is the molecular formula of N-benzyl-4,6-difluoropyrimidin-2-amine?
The molecular formula of N-benzyl-4,6-difluoropyrimidin-2-amine is C11H9F2N3.
What is the molecular weight of N-benzyl-4,6-difluoropyrimidin-2-amine?
The molecular weight of N-benzyl-4,6-difluoropyrimidin-2-amine is 221.07645 g/mol.
Where can I buy N-benzyl-4,6-difluoropyrimidin-2-amine?
You can request a quote for N-benzyl-4,6-difluoropyrimidin-2-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-benzyl-4,6-difluoropyrimidin-2-amine?
Yes, CoreyChem provides custom synthesis services for N-benzyl-4,6-difluoropyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.