TL;DR: 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline (CAS 1164523-95-8) is a chemical compound with molecular formula C14H9Cl2F3N2 and molecular weight 332.0095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline
Also Known As: 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethenyl]aniline, N-(2-chlorophenyl)-N-{2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]vinyl}amine
| Molecular Formula | C14H9Cl2F3N2 |
| Molecular Weight | 332.0095 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 24.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.0095 Da |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
| SMILES | C1=CC=C(C(=C1)NC=CC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl |
| InChIKey | FLLYKGWESXKWTJ-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.9 Ų, 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline 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 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline is 1164523-95-8.
The molecular formula of 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline is C14H9Cl2F3N2.
The molecular weight of 2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]aniline is 332.0095 g/mol.
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