TL;DR: Penaresidin (CAS 135574-62-8) is a chemical compound with molecular formula C19H39NO3 and molecular weight 329.293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4S)-2-(hydroxymethyl)-4-[(11R,12R)-11-hydroxy-12-methyltetradecyl]azetidin-3-ol
Also Known As: Penaresidin, Penaresidin A, Penaresidine A, Allopenaresidin A, (+)-Penaresidine A
| Molecular Formula | C19H39NO3 |
| Molecular Weight | 329.293 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 72.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 329.293 Da |
| Heavy Atoms | 23 |
| Complexity | 288.0 |
| SMILES | CC[C@@H](C)[C@@H](CCCCCCCCCC[C@H]1[C@H]([C@@H](N1)CO)O)O |
| InChIKey | VVMSPNITCDMCDP-ICBNADEASA-N |
The XLogP value of 4.7 indicates that Penaresidin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Penaresidin. Following Lipinski's Rule of Five, Penaresidin has 4 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 Penaresidin is 135574-62-8.
The molecular formula of Penaresidin is C19H39NO3.
The molecular weight of Penaresidin is 329.293 g/mol.
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