TL;DR: Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)- (CAS 108865-98-1) is a chemical compound with molecular formula C7H11NO2S and molecular weight 173.05106 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,2-dimethyl-4-oxothietan-3-yl)acetamide
Also Known As: N-(2,2-dimethyl-4-oxothietan-3-yl)acetamide, Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)-, IDI1_021497, J1.542.272F, N-(2-Oxo-4,4-dimethylthietane-3-yl)acetamide
| Molecular Formula | C7H11NO2S |
| Molecular Weight | 173.05106 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.05106 Da |
| Heavy Atoms | 11 |
| Complexity | 212.0 |
| SMILES | CC(=O)NC1C(=O)SC1(C)C |
| InChIKey | LFIQZXJVBJYDNW-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)-. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)-. Following Lipinski's Rule of Five, Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)- 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 Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)- is 108865-98-1.
The molecular formula of Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)- is C7H11NO2S.
The molecular weight of Acetamide, N-(2,2-dimethyl-4-oxo-3-thietanyl)- is 173.05106 g/mol.
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