TL;DR: N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide (CAS 1024531-07-4) is a chemical compound with molecular formula C17H12ClNO3 and molecular weight 313.05057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]acetamide
Also Known As: N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]acetamide, N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide, N-(3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl)acetamide
| Molecular Formula | C17H12ClNO3 |
| Molecular Weight | 313.05057 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.05057 Da |
| Heavy Atoms | 22 |
| Complexity | 490.0 |
| SMILES | CC(=O)NC1=CC(=C(C=C1)C2=CC3=CC=CC=C3OC2=O)Cl |
| InChIKey | OAEMMWVTNAFMDD-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]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-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide is 1024531-07-4.
The molecular formula of N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide is C17H12ClNO3.
The molecular weight of N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]acetamide is 313.05057 g/mol.
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