TL;DR: 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide (CAS 1025209-24-8) is a chemical compound with molecular formula C19H18N2O2 and molecular weight 306.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,3-dihydroindol-1-ylmethylidene)-3-oxo-N-phenylbutanamide
Also Known As: 2-ACETYL-3-INDOLINYL-N-PHENYLPROP-2-ENAMIDE, 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide, 2-(2,3-dihydroindol-1-ylmethylidene)-3-oxo-N-phenylbutanamide, 2-(2,3-dihydroindol-1-ylmethylidene)-3-oxo-N-phenyl-butanamide, (2E)-2-[(2,3-dihydro-1H-indol-1-yl)methylidene]-3-oxo-N-phenylbutanamide
| Molecular Formula | C19H18N2O2 |
| Molecular Weight | 306.13684 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.13684 Da |
| Heavy Atoms | 23 |
| Complexity | 480.0 |
| SMILES | CC(=O)C(=CN1CCC2=CC=CC=C21)C(=O)NC3=CC=CC=C3 |
| InChIKey | IVPIIXPMQRZPCU-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide 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 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide is 1025209-24-8.
The molecular formula of 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide is C19H18N2O2.
The molecular weight of 2-(indolin-1-ylmethylene)-3-oxo-N-phenyl-butanamide is 306.13684 g/mol.
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