N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
TL;DR: N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide (CAS 1005635-18-6) is a chemical compound with molecular formula C12H5BrF7N3O and molecular weight 418.9504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide
Also Known As: N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide, N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide, N-(4-bromo-2,3,5,6-tetrafluoro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide
Technical Specifications
| Molecular Formula | C12H5BrF7N3O |
| Molecular Weight | 418.9504 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 418.9504 Da |
| Heavy Atoms | 24 |
| Complexity | 466.0 |
| SMILES | CN1C(=CC(=N1)C(=O)NC2=C(C(=C(C(=C2F)F)Br)F)F)C(F)(F)F |
| InChIKey | VPBKAFATIQSHIE-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Property Insights of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
The XLogP value of 3.4 indicates that N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide has 1 hydrogen bond donor(s) and 9 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-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
The CAS number of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide is 1005635-18-6.
What is the molecular formula of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
The molecular formula of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide is C12H5BrF7N3O.
What is the molecular weight of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
The molecular weight of N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide is 418.9504 g/mol.
Where can I buy N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
You can request a quote for N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-(4-bromo-2,3,5,6-tetrafluorophenyl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.