TL;DR: N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide (CAS 126956-23-8) is a chemical compound with molecular formula C6H5Cl2NO3 and molecular weight 208.96465 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,4-dichloro-5-oxo-2H-furan-2-yl)acetamide
Also Known As: BAS 00135712, N-(3,4-dichloro-5-oxo-2H-furan-2-yl)acetamide, N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide, N-(3,4-dichloro-5-oxo-2-2-hydrofuryl)acetamide, N-(3,4-Dichloro-5-oxo-2,5-dihydro-furan-2-yl)-acetamide
| Molecular Formula | C6H5Cl2NO3 |
| Molecular Weight | 208.96465 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.96465 Da |
| Heavy Atoms | 12 |
| Complexity | 274.0 |
| SMILES | CC(=O)NC1C(=C(C(=O)O1)Cl)Cl |
| InChIKey | BBVVQNGWAVQZDK-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide. With a topological polar surface area (TPSA) of 55.4 Ų, N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-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-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide is 126956-23-8.
The molecular formula of N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide is C6H5Cl2NO3.
The molecular weight of N-(3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetamide is 208.96465 g/mol.
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