TL;DR: N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide (CAS 1005631-15-1) is a chemical compound with molecular formula C18H15FN4O3 and molecular weight 354.11282 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide
Also Known As: N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide, N-(3-fluorophenyl)-2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzamide, N-(3-fluorophenyl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide
| Molecular Formula | C18H15FN4O3 |
| Molecular Weight | 354.11282 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 92.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.11282 Da |
| Heavy Atoms | 26 |
| Complexity | 515.0 |
| SMILES | CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=CC(=CC=C3)F)[N+](=O)[O-] |
| InChIKey | IQTIRKDZLIIZRN-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide. Following Lipinski's Rule of Five, N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide 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 N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is 1005631-15-1.
The molecular formula of N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is C18H15FN4O3.
The molecular weight of N-(3-fluorophenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is 354.11282 g/mol.
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