TL;DR: 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide (CAS 165618-95-1) is a chemical compound with molecular formula C9H9F3N2O3S and molecular weight 282.0286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide
Also Known As: 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide, 2,2,2-trifluoro-N-(4-sulfamoylbenzyl)acetamide, N-(4-Sulfamoylbenzyl)-2,2,2-trifluoroacetamide, N-[4-(Aminosulfonyl)benzyl]-2,2,2-trifluoroacetamide
| Molecular Formula | C9H9F3N2O3S |
| Molecular Weight | 282.0286 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 97.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.0286 Da |
| Heavy Atoms | 18 |
| Complexity | 394.0 |
| SMILES | C1=CC(=CC=C1CNC(=O)C(F)(F)F)S(=O)(=O)N |
| InChIKey | PSURAFILOCZAMG-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide. Following Lipinski's Rule of Five, 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide is 165618-95-1.
The molecular formula of 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide is C9H9F3N2O3S.
The molecular weight of 2,2,2-trifluoro-N-[(4-sulfamoylphenyl)methyl]acetamide is 282.0286 g/mol.
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