TL;DR: 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide (CAS 303061-71-4) is a chemical compound with molecular formula C23H21N3O4 and molecular weight 403.1532 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-N-[[(3-methylbenzoyl)amino]-(3-nitrophenyl)methyl]benzamide
Also Known As: BIM-0046856.P001, N,N'-[(3-nitrophenyl)methanediyl]bis(3-methylbenzamide), N,N'-[(3-nitrophenyl)methylene]bis(3-methylbenzamide), 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide, 3-methyl-N-[[(3-methylbenzoyl)amino](3-nitrophenyl)methyl]benzamide
| Molecular Formula | C23H21N3O4 |
| Molecular Weight | 403.1532 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.1532 Da |
| Heavy Atoms | 30 |
| Complexity | 584.0 |
| SMILES | CC1=CC(=CC=C1)C(=O)NC(C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CC(=C3)C |
| InChIKey | CHSRNYZHEMCXMZ-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide. Following Lipinski's Rule of Five, 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide 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 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide is 303061-71-4.
The molecular formula of 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide is C23H21N3O4.
The molecular weight of 3-Methyl-N-(((3-methylbenzoyl)amino)(3-nitrophenyl)methyl)benzamide is 403.1532 g/mol.
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