TL;DR: 3-Ethylindolin-2-one (CAS 15379-45-0) is a chemical compound with molecular formula C10H11NO and molecular weight 161.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethyl-1,3-dihydroindol-2-one
Also Known As: 3-ETHYLINDOLIN-2-ONE, 3-ethyloxindole, 3-ethyloxyindole, 3-ethyl-1,3-dihydroindol-2-one, 3-Ethylindoline-2-one
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H11NO |
| Molecular Weight | 161.08406 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.08406 Da |
| Heavy Atoms | 12 |
| Complexity | 190.0 |
| SMILES | CCC1C2=CC=CC=C2NC1=O |
| InChIKey | IPHNYSQCMZUVDY-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethylindolin-2-one. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Ethylindolin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethylindolin-2-one has 1 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 3-Ethylindolin-2-one is 15379-45-0.
The molecular formula of 3-Ethylindolin-2-one is C10H11NO.
The molecular weight of 3-Ethylindolin-2-one is 161.08406 g/mol.
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