TL;DR: Dabelotine, (S)- (CAS 152985-35-8) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(1-methyl-3,4-dihydro-2H-quinolin-8-yl)oxymethyl]morpholine
Also Known As: Dabelotine, (S)-, Dabelotine, (S)-dabelotine, Quinoline, 1,2,3,4-tetrahydro-1-methyl-8-((2S)-2-morpholinylmethoxy)-, (S)-, (2S)-2-[(1-methyl-3,4-dihydro-2H-quinolin-8-yl)oxymethyl]morpholine
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H22N2O2 |
| Molecular Weight | 262.16812 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.16812 Da |
| Heavy Atoms | 19 |
| Complexity | 287.0 |
| SMILES | CN1CCCC2=C1C(=CC=C2)OC[C@@H]3CNCCO3 |
| InChIKey | VXQWMLATWQSCBE-ZDUSSCGKSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dabelotine, (S)-. With a topological polar surface area (TPSA) of 33.7 Ų, Dabelotine, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dabelotine, (S)- 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 Dabelotine, (S)- is 152985-35-8.
The molecular formula of Dabelotine, (S)- is C15H22N2O2.
The molecular weight of Dabelotine, (S)- is 262.16812 g/mol.
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