TL;DR: L 652117 (CAS 127020-81-9) is a chemical compound with molecular formula C14H16N2O7S and molecular weight 356.0678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2S)-3-ethyl-1-(4-nitrophenyl)sulfonyl-4-oxoazetidine-2-carboxylate
Also Known As: L 652117, L 652306, L-652117, L-652306, L 652,117
| Molecular Formula | C14H16N2O7S |
| Molecular Weight | 356.0678 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.0678 Da |
| Heavy Atoms | 24 |
| Complexity | 614.0 |
| SMILES | CCC1[C@H](N(C1=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC |
| InChIKey | FYFRVXKQSCCYAE-KIYNQFGBSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L 652117. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for L 652117. Following Lipinski's Rule of Five, L 652117 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of L 652117 is 127020-81-9.
The molecular formula of L 652117 is C14H16N2O7S.
The molecular weight of L 652117 is 356.0678 g/mol.
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