TL;DR: 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide (CAS 1005659-71-1) is a chemical compound with molecular formula C14H20F2N4O and molecular weight 298.16052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide
Also Known As: 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide, 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-(3-methylcyclohexylidene)acetohydrazide, 2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide
| Molecular Formula | C14H20F2N4O |
| Molecular Weight | 298.16052 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.16052 Da |
| Heavy Atoms | 21 |
| Complexity | 402.0 |
| SMILES | CC1CCC/C(=N/NC(=O)CN2C(=CC(=N2)C(F)F)C)/C1 |
| InChIKey | GYMHUZZPQXWDCQ-BOPFTXTBSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide. With a topological polar surface area (TPSA) of 59.3 Ų, 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide 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-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide is 1005659-71-1.
The molecular formula of 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide is C14H20F2N4O.
The molecular weight of 2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N'-[(1Z)-3-methylcyclohexylidene]acetohydrazide is 298.16052 g/mol.
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