TL;DR: Xinidamine (CAS 50264-78-3) is a chemical compound with molecular formula C17H16N2O2 and molecular weight 280.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2,4-dimethylphenyl)methyl]indazole-3-carboxylic acid
Also Known As: Xinidamine, Xinidaminum, Xinidamino, Xinidamine [INN], Xinidamina
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H16N2O2 |
| Molecular Weight | 280.1212 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.1212 Da |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
| SMILES | CC1=CC(=C(C=C1)CN2C3=CC=CC=C3C(=N2)C(=O)O)C |
| InChIKey | WHWIXTDKNBCRAS-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that Xinidamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, Xinidamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xinidamine 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 Xinidamine is 50264-78-3.
The molecular formula of Xinidamine is C17H16N2O2.
The molecular weight of Xinidamine is 280.1212 g/mol.
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