TL;DR: 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone (CAS 15866-36-1) is a chemical compound with molecular formula C16H13N5O4 and molecular weight 339.09674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2-hydroxy-4-nitrophenyl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one
Also Known As: HNAPMP, 2,4-DIHYDRO-4-[(2-HYDROXY-4-NITROPHENYL)AZO]-5-METHYL-2-PHENYL-3H-PYRAZOL-3-ONE, 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone, 3-Methyl-1-phenyl-4-(5-nitro-o-phenolazo)-5-pyrazolon, 4-[(2-hydroxy-4-nitrophenyl)diazenyl]-5-methyl-2-phenyl-4H-pyrazol-3-one
| Molecular Formula | C16H13N5O4 |
| Molecular Weight | 339.09674 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.09674 Da |
| Heavy Atoms | 25 |
| Complexity | 582.0 |
| SMILES | CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])O)C3=CC=CC=C3 |
| InChIKey | ULPPOWQPJBUQOF-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone. Following Lipinski's Rule of Five, 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone is 15866-36-1.
The molecular formula of 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone is C16H13N5O4.
The molecular weight of 4-(2-Hydroxy-4-nitrophenylazo)-1-phenyl-3-methylpyrazolone is 339.09674 g/mol.
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