TL;DR: Isoremoxipride C-11 (CAS 167637-45-8) is a chemical compound with molecular formula C16H23BrN2O3 and molecular weight 369.10065 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-3-methoxy-2-(111C)methoxy(11C)benzamide
Also Known As: Isoremoxipride C-11, [11C]isoremoxipride, (11C)Flb-457, Flb 457, FLB-457 C-11
| Molecular Formula | C16H23BrN2O3 |
| Molecular Weight | 369.10065 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.10065 Da |
| Heavy Atoms | 22 |
| Complexity | 369.0 |
| SMILES | CCN1CCC[C@H]1CNC(=O)C2=C(C(=CC(=C2)Br)OC)O[11CH3] |
| InChIKey | QAECXZXKVURFMR-SPFAIMGWSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoremoxipride C-11. With a topological polar surface area (TPSA) of 50.8 Ų, Isoremoxipride C-11 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoremoxipride C-11 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 Isoremoxipride C-11 is 167637-45-8.
The molecular formula of Isoremoxipride C-11 is C16H23BrN2O3.
The molecular weight of Isoremoxipride C-11 is 369.10065 g/mol.
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