TL;DR: Porritoxin (CAS 143114-82-3) is a chemical compound with molecular formula C17H23NO4 and molecular weight 305.16272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-hydroxyethyl)-4-methoxy-5-methyl-6-(3-methylbut-2-enoxy)-3H-isoindol-1-one
Also Known As: Porritoxin, 2-(2-hydroxyethyl)-4-methoxy-5-methyl-6-(3-methylbut-2-enoxy)-3H-isoindol-1-one, J1.795.174B, 2-(2'-Hydroxyethyl)-4-methoxy-5-methyl-6-(3''-methyl-2''-butenyloxy)-2,3-dihydro-1H-isoindol-1-one, 2-(2-hydroxyethyl)-4-methoxy-5-methyl-6-(3-methylbut-2-enoxy)isoindolin-1-one
| Molecular Formula | C17H23NO4 |
| Molecular Weight | 305.16272 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 305.16272 Da |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
| SMILES | CC1=C(C=C2C(=C1OC)CN(C2=O)CCO)OCC=C(C)C |
| InChIKey | RKLUTDADUQVUMB-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Porritoxin. With a topological polar surface area (TPSA) of 59.0 Ų, Porritoxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Porritoxin has 1 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 Porritoxin is 143114-82-3.
The molecular formula of Porritoxin is C17H23NO4.
The molecular weight of Porritoxin is 305.16272 g/mol.
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