TL;DR: Bionet1_001292 (CAS 158713-25-8) is a chemical compound with molecular formula C13H8ClF6N3O and molecular weight 371.026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-1-methyl-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
Also Known As: Bionet1_001292, 2F-403S, 5-chloro-1-methyl-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide, 5-chloro-1-methyl-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
| Molecular Formula | C13H8ClF6N3O |
| Molecular Weight | 371.026 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 371.026 Da |
| Heavy Atoms | 24 |
| Complexity | 472.0 |
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)C(=O)NC2=CC=CC(=C2)C(F)(F)F)Cl |
| InChIKey | HMCOXLKCZUGHOC-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that Bionet1_001292 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, Bionet1_001292 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_001292 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bionet1_001292 is 158713-25-8.
The molecular formula of Bionet1_001292 is C13H8ClF6N3O.
The molecular weight of Bionet1_001292 is 371.026 g/mol.
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