TL;DR: 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide (CAS 1004643-35-9) is a chemical compound with molecular formula C11H11N5O4 and molecular weight 277.08112 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2-nitrophenoxy)methyl]pyrazole-3-carbohydrazide
Also Known As: 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide, 1-[(2-nitrophenoxy)methyl]pyrazole-3-carbohydrazide, 1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carbohydrazide, 1-(2-nitrophenoxy)methyl-1H-pyrazole-3-carbohydrazide, 1-(2-Nitro-phenoxymethyl)-1H-pyrazole-3-carboxylic acid hydrazide
| Molecular Formula | C11H11N5O4 |
| Molecular Weight | 277.08112 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.08112 Da |
| Heavy Atoms | 20 |
| Complexity | 361.0 |
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OCN2C=CC(=N2)C(=O)NN |
| InChIKey | YVBKGELWTUGJGW-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide. Following Lipinski's Rule of Five, 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide is 1004643-35-9.
The molecular formula of 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide is C11H11N5O4.
The molecular weight of 1-((2-Nitrophenoxy)methyl)-1H-pyrazole-3-carbohydrazide is 277.08112 g/mol.
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