TL;DR: 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide (CAS 667444-04-4) is a chemical compound with molecular formula C13H8ClF3N2O and molecular weight 300.0277 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
Also Known As: 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide, 6-Chloro-N-[4-(trifluoromethyl)phenyl]nicotinamide, AB00735556-01, (6-chloro(3-pyridyl))-N-[4-(trifluoromethyl)phenyl]carboxamide
| Molecular Formula | C13H8ClF3N2O |
| Molecular Weight | 300.0277 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.0277 Da |
| Heavy Atoms | 20 |
| Complexity | 343.0 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)NC(=O)C2=CN=C(C=C2)Cl |
| InChIKey | PJTGTQCMCBSMLP-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide is 667444-04-4.
The molecular formula of 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide is C13H8ClF3N2O.
The molecular weight of 6-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide is 300.0277 g/mol.
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