TL;DR: N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide (CAS 107920-21-8) is a chemical compound with molecular formula C14H12N2O3 and molecular weight 256.08478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide
Also Known As: N-(1,2-Dihydro-6-nitro-5-acenaphthylenyl)acetamide, N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide
| Molecular Formula | C14H12N2O3 |
| Molecular Weight | 256.08478 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.08478 Da |
| Heavy Atoms | 19 |
| Complexity | 393.0 |
| SMILES | CC(=O)NC1=C2C(=CC=C3C2=C(CC3)C=C1)[N+](=O)[O-] |
| InChIKey | NKPVEXMEBTXZHW-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide. Following Lipinski's Rule of Five, N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide is 107920-21-8.
The molecular formula of N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide is C14H12N2O3.
The molecular weight of N-(6-nitro-1,2-dihydroacenaphthylen-5-yl)acetamide is 256.08478 g/mol.
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