TL;DR: Traxoprodil (CAS 15571-11-6) is a chemical compound with molecular formula C20H25NO3 and molecular weight 327.18344 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(1S,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]-4-phenylpiperidin-4-ol
Also Known As: Traxoprodil, Traxoprodil [INN], nective, traxoprodilum, Traxoprodil mesylate
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H25NO3 |
| Molecular Weight | 327.18344 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 63.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.18344 Da |
| Heavy Atoms | 24 |
| Complexity | 380.0 |
| SMILES | C[C@@H]([C@H](C1=CC=C(C=C1)O)O)N2CCC(CC2)(C3=CC=CC=C3)O |
| InChIKey | QEMSVZNTSXPFJA-HNAYVOBHSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Traxoprodil. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Traxoprodil. Following Lipinski's Rule of Five, Traxoprodil has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Traxoprodil is 15571-11-6.
The molecular formula of Traxoprodil is C20H25NO3.
The molecular weight of Traxoprodil is 327.18344 g/mol.
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