TL;DR: N-(2,4-dinitrophenyl)-N-phenylacetamide (CAS 106038-76-0) is a chemical compound with molecular formula C14H11N3O5 and molecular weight 301.0699 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,4-dinitrophenyl)-N-phenylacetamide
Also Known As: 2,4-Dinitrodiphenylacetamide, N-(2,4-dinitrophenyl)-N-phenylacetamide, 2,4-Dinitro[(acetylimino)bisbenzene], N-{2,4-bisnitrophenyl}-N-phenylacetamide, AE-641/30106001
| Molecular Formula | C14H11N3O5 |
| Molecular Weight | 301.0699 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.0699 Da |
| Heavy Atoms | 22 |
| Complexity | 439.0 |
| SMILES | CC(=O)N(C1=CC=CC=C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | SEMUUQOWHQGGFF-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4-dinitrophenyl)-N-phenylacetamide. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-dinitrophenyl)-N-phenylacetamide. Following Lipinski's Rule of Five, N-(2,4-dinitrophenyl)-N-phenylacetamide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(2,4-dinitrophenyl)-N-phenylacetamide is 106038-76-0.
The molecular formula of N-(2,4-dinitrophenyl)-N-phenylacetamide is C14H11N3O5.
The molecular weight of N-(2,4-dinitrophenyl)-N-phenylacetamide is 301.0699 g/mol.
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