TL;DR: N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide (CAS 152586-95-3) is a chemical compound with molecular formula C15H13N3O7 and molecular weight 347.07535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide
Also Known As: N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide, N-(3,5-Dimethoxyphenyl)-3,5-dinitrobenzamide, 97%
| Molecular Formula | C15H13N3O7 |
| Molecular Weight | 347.07535 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.07535 Da |
| Heavy Atoms | 25 |
| Complexity | 470.0 |
| SMILES | COC1=CC(=CC(=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OC |
| InChIKey | JDBHZANBSGYAIO-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide 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 N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide is 152586-95-3.
The molecular formula of N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide is C15H13N3O7.
The molecular weight of N-(3,5-dimethoxyphenyl)-3,5-dinitrobenzamide is 347.07535 g/mol.
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