TL;DR: (S)-Indoprofen (CAS 53086-13-8) is a chemical compound with molecular formula C17H15NO3 and molecular weight 281.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[4-(3-oxo-1H-isoindol-2-yl)phenyl]propanoic acid
Also Known As: Dexindoprofen, Dexindoprofene, Dexindoprofeno, Dexindoprofenum, Nedius
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H15NO3 |
| Molecular Weight | 281.1052 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.1052 Da |
| Heavy Atoms | 21 |
| Complexity | 414.0 |
| SMILES | C[C@@H](C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O)C(=O)O |
| InChIKey | RJMIEHBSYVWVIN-NSHDSACASA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Indoprofen. With a topological polar surface area (TPSA) of 57.6 Ų, (S)-Indoprofen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-Indoprofen 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 (S)-Indoprofen is 53086-13-8.
The molecular formula of (S)-Indoprofen is C17H15NO3.
The molecular weight of (S)-Indoprofen is 281.1052 g/mol.
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