TL;DR: N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide (CAS 1005615-68-8) is a chemical compound with molecular formula C15H13ClF5N3O and molecular weight 381.06674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide
Also Known As: N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide, N-{3-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}-2,6-difluorobenzamide, N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluoro-benzamide
| Molecular Formula | C15H13ClF5N3O |
| Molecular Weight | 381.06674 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.06674 Da |
| Heavy Atoms | 25 |
| Complexity | 457.0 |
| SMILES | CC1=C(C(=NN1CCCNC(=O)C2=C(C=CC=C2F)F)C(F)(F)F)Cl |
| InChIKey | QEAXISUPRMYVDW-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide 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-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide is 1005615-68-8.
The molecular formula of N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide is C15H13ClF5N3O.
The molecular weight of N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2,6-difluorobenzamide is 381.06674 g/mol.
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