TL;DR: Aziridinone, 1,3-bis(1,1-dimethylethyl)- (CAS 130014-19-6) is a chemical compound with molecular formula C10H19NO and molecular weight 169.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-ditert-butylaziridin-2-one
Also Known As: 1,3-Di-tert-butylaziridinone, 1,3-di-t-butylaziridinone, 1,3-Di-tert-butylaziridinon, 1,3-di-tert-butylaziridin-2-one, 2-Aziridinone, 1,3-di-tert-butyl-
| Molecular Formula | C10H19NO |
| Molecular Weight | 169.14667 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 20.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.14667 Da |
| Heavy Atoms | 12 |
| Complexity | 207.0 |
| SMILES | CC(C)(C)C1C(=O)N1C(C)(C)C |
| InChIKey | CEPIDWHUQBLHJH-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aziridinone, 1,3-bis(1,1-dimethylethyl)-. With a topological polar surface area (TPSA) of 20.1 Ų, Aziridinone, 1,3-bis(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aziridinone, 1,3-bis(1,1-dimethylethyl)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Aziridinone, 1,3-bis(1,1-dimethylethyl)- is 130014-19-6.
The molecular formula of Aziridinone, 1,3-bis(1,1-dimethylethyl)- is C10H19NO.
The molecular weight of Aziridinone, 1,3-bis(1,1-dimethylethyl)- is 169.14667 g/mol.
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