TL;DR: (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate (CAS 1212363-46-6) is a chemical compound with molecular formula C17H21NO3 and molecular weight 287.15213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,2,4-trimethyl-1H-quinolin-6-yl) (2S)-oxolane-2-carboxylate
Also Known As: (2,2,4-trimethyl-1H-quinolin-6-yl) (2S)-oxolane-2-carboxylate, (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate
| Molecular Formula | C17H21NO3 |
| Molecular Weight | 287.15213 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.15213 Da |
| Heavy Atoms | 21 |
| Complexity | 443.0 |
| SMILES | CC1=CC(NC2=C1C=C(C=C2)OC(=O)[C@@H]3CCCO3)(C)C |
| InChIKey | SQRBRJKPNNKVOT-HNNXBMFYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate. With a topological polar surface area (TPSA) of 47.6 Ų, (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate 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 (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate is 1212363-46-6.
The molecular formula of (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate is C17H21NO3.
The molecular weight of (S)-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl tetrahydrofuran-2-carboxylate is 287.15213 g/mol.
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