TL;DR: 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide (CAS 108112-52-3) is a chemical compound with molecular formula C26H16N6O6 and molecular weight 508.11313 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-nitro-N-[3-[(3-nitrobenzoyl)amino]phenazin-2-yl]benzamide
Also Known As: N,N'-(Phenazine-2,3-diyl)bis(3-nitrobenzamide), Benzamide, N,N'-2,3-phenazinediylbis[3-nitro-, 3-nitro-N-[3-[(3-nitrobenzoyl)amino]phenazin-2-yl]benzamide, Benzamide, N,N//'-2,3-phenazinediylbis[3-nitro-, AE-641/00348030
| Molecular Formula | C26H16N6O6 |
| Molecular Weight | 508.11313 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 176.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.11313 Da |
| Heavy Atoms | 38 |
| Complexity | 836.0 |
| SMILES | C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])NC(=O)C5=CC(=CC=C5)[N+](=O)[O-] |
| InChIKey | QNZWKZXADVUCFT-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 176.0 Ų indicates high polarity, suggesting 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide is 108112-52-3.
The molecular formula of 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide is C26H16N6O6.
The molecular weight of 3-Nitro-N-(3-((3-nitrobenzoyl)amino)-2-phenazinyl)benzamide is 508.11313 g/mol.
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