TL;DR: C22H23F2NO2 (CAS 1008413-72-6) is a chemical compound with molecular formula C22H23F2NO2 and molecular weight 371.16968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-fluorophenyl)-[1-(4-fluorophenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]methanone
Also Known As: (3-fluorophenyl)(1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)methanone, (3-fluorophenyl)[1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]methanone, (3-fluorophenyl)-[1-(4-fluorophenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]methanone, C22H23F2NO2
| Molecular Formula | C22H23F2NO2 |
| Molecular Weight | 371.16968 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 371.16968 Da |
| Heavy Atoms | 27 |
| Complexity | 536.0 |
| SMILES | C1CCC2(CCN(C(C2C1)C3=CC=C(C=C3)F)C(=O)C4=CC(=CC=C4)F)O |
| InChIKey | WVABFNXIPMDRAJ-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that C22H23F2NO2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, C22H23F2NO2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C22H23F2NO2 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 C22H23F2NO2 is 1008413-72-6.
The molecular formula of C22H23F2NO2 is C22H23F2NO2.
The molecular weight of C22H23F2NO2 is 371.16968 g/mol.
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