TL;DR: 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl- (CAS 106609-76-1) is a chemical compound with molecular formula C14H16ClNO2 and molecular weight 265.08694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-5-[(dimethylamino)methyl]-5-methyl-4-phenylfuran-2-one
Also Known As: 3-Chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl-2(5H)-furanone, 3-chloro-5-(dimethylaminomethyl)-5-methyl-4-phenylfuran-2-one, 2(5H)-FURANONE, 3-CHLORO-5-((DIMETHYLAMINO)METHYL)-5-METHYL-4-PHENYL-, 3-chloro-5-[(dimethylamino)methyl]-5-methyl-4-phenylfuran-2-one, 3-chloro-5-[(dimethylamino)methyl]-5-methyl-4-phenylfuran-2(5h)-one
| Molecular Formula | C14H16ClNO2 |
| Molecular Weight | 265.08694 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.08694 Da |
| Heavy Atoms | 18 |
| Complexity | 372.0 |
| SMILES | CC1(C(=C(C(=O)O1)Cl)C2=CC=CC=C2)CN(C)C |
| InChIKey | ODLWXXDTMOWJMA-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl-. With a topological polar surface area (TPSA) of 29.5 Ų, 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl- 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 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl- is 106609-76-1.
The molecular formula of 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl- is C14H16ClNO2.
The molecular weight of 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-5-methyl-4-phenyl- is 265.08694 g/mol.
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