TL;DR: 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one (CAS 303985-88-8) is a chemical compound with molecular formula C14H14N2O2 and molecular weight 242.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one
Also Known As: 1-[4-(5-isoxazolyl)phenyl]-3,3-dimethyl-2-azetanone, 3,3-dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one, 11L-714, 1-(4-isoxazol-5-ylphenyl)-3,3-dimethyl-azetidin-2-one
| Molecular Formula | C14H14N2O2 |
| Molecular Weight | 242.10553 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.10553 Da |
| Heavy Atoms | 18 |
| Complexity | 335.0 |
| SMILES | CC1(CN(C1=O)C2=CC=C(C=C2)C3=CC=NO3)C |
| InChIKey | VHGUIMDRRDIHJN-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one. With a topological polar surface area (TPSA) of 46.3 Ų, 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one has 0 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 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one is 303985-88-8.
The molecular formula of 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one is C14H14N2O2.
The molecular weight of 3,3-Dimethyl-1-[4-(1,2-oxazol-5-yl)phenyl]azetidin-2-one is 242.10553 g/mol.
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