TL;DR: F1581-0020 (CAS 1001785-78-9) is a chemical compound with molecular formula C22H24N2O2S and molecular weight 380.15585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-2-(2,4-dimethylphenoxy)ethanone
Also Known As: F1581-0020, 1-{3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}-2-(2,4-dimethylphenoxy)ethan-1-one, 1-(3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)-2-(2,4-dimethylphenoxy)ethanone, 1-[3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-2-(2,4-dimethylphenoxy)ethanone
| Molecular Formula | C22H24N2O2S |
| Molecular Weight | 380.15585 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.15585 Da |
| Heavy Atoms | 27 |
| Complexity | 495.0 |
| SMILES | CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(=O)COC3=C(C=C(C=C3)C)C)C |
| InChIKey | OSPCQYJIEZWMGS-UHFFFAOYSA-N |
The XLogP value of 5.8 indicates that F1581-0020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for F1581-0020. Following Lipinski's Rule of Five, F1581-0020 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of F1581-0020 is 1001785-78-9.
The molecular formula of F1581-0020 is C22H24N2O2S.
The molecular weight of F1581-0020 is 380.15585 g/mol.
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