TL;DR: N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide (CAS 847850-67-3) is a chemical compound with molecular formula C27H25N3O3 and molecular weight 439.1896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-(4-methylpiperazin-1-yl)phenyl]-4-(2-oxochromen-3-yl)benzamide
Also Known As: N-[4-(4-methylpiperazin-1-yl)phenyl]-4-(2-oxochromen-3-yl)benzamide, N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide, N-[4-(4-methylpiperazin-1-yl)phenyl]-4-(2-oxo-2H-chromen-3-yl)benzamide
| Molecular Formula | C27H25N3O3 |
| Molecular Weight | 439.1896 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 61.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 439.1896 Da |
| Heavy Atoms | 33 |
| Complexity | 729.0 |
| SMILES | CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O |
| InChIKey | ZISACVKNFVFGAB-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide. Following Lipinski's Rule of Five, N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide has 1 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-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide is 847850-67-3.
The molecular formula of N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide is C27H25N3O3.
The molecular weight of N-(4-(4-methylpiperazin-1-yl)phenyl)-4-(2-oxo-2H-chromen-3-yl)benzamide is 439.1896 g/mol.
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