TL;DR: Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro- (CAS 63981-16-8) is a chemical compound with molecular formula C15H14N2O4 and molecular weight 286.09537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,5-dimethylphenyl)-2-hydroxy-3-nitrobenzamide
Also Known As: 2',3-nitro, 2', 3-nitro-, N-(2,5-Dimethylphenyl)-2-hydroxy-3-nitrobenzamide, 2',5'-Salicyloxylidide, 3-nitro-, N- -2-hydroxy-3-nitrobenzamide
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H14N2O4 |
| Molecular Weight | 286.09537 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.09537 Da |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])O |
| InChIKey | ZHSZKAUBTWMIHX-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro-. Following Lipinski's Rule of Five, Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro- is 63981-16-8.
The molecular formula of Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro- is C15H14N2O4.
The molecular weight of Benzamide, N-(2,5-dimethylphenyl)-2-hydroxy-3-nitro- is 286.09537 g/mol.
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