TL;DR: 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine (CAS 66000-40-6) is a chemical compound with molecular formula C10H10F3N3 and molecular weight 229.08269 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-amine
Also Known As: BW 755C, BW755C, BW-755C, Compound BW-755C, COMPOUND BW 755C
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H10F3N3 |
| Molecular Weight | 229.08269 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.08269 Da |
| Heavy Atoms | 16 |
| Complexity | 288.0 |
| SMILES | C1CN(N=C1N)C2=CC=CC(=C2)C(F)(F)F |
| InChIKey | CPXGGWXJNQSFEP-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine. With a topological polar surface area (TPSA) of 41.6 Ų, 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine 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 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine is 66000-40-6.
The molecular formula of 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine is C10H10F3N3.
The molecular weight of 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine is 229.08269 g/mol.
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