TL;DR: Guaiactamine (CAS 15687-23-7) is a chemical compound with molecular formula C13H21NO2 and molecular weight 223.15723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-2-(2-methoxyphenoxy)ethanamine
Also Known As: Guaiactamine, Gaiactamine, Guayactamina, Guaiactaminum, Guaiactamine [INN]
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H21NO2 |
| Molecular Weight | 223.15723 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 223.15723 Da |
| Heavy Atoms | 16 |
| Complexity | 171.0 |
| SMILES | CCN(CC)CCOC1=CC=CC=C1OC |
| InChIKey | OTEAKJIIJRDXBV-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guaiactamine. With a topological polar surface area (TPSA) of 21.7 Ų, Guaiactamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Guaiactamine 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 Guaiactamine is 15687-23-7.
The molecular formula of Guaiactamine is C13H21NO2.
The molecular weight of Guaiactamine is 223.15723 g/mol.
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