TL;DR: Chemical Compound (C12H21NO8S) (CAS 1279037-95-4) is a chemical compound with molecular formula C12H21NO8S and molecular weight 339.0988 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1R,2S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-6-yl]methyl sulfamate
| Molecular Formula | C12H21NO8S |
| Molecular Weight | 339.0988 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.0988 Da |
| Heavy Atoms | 22 |
| Complexity | 556.0 |
| SMILES | CC1(O[C@@H]2COC3([C@H]([C@@H]2O1)OC(O3)(C)C)COS(=O)(=O)N)C |
| InChIKey | KJADKKWYZYXHBB-PDBLZVRPSA-N |
The XLogP value of -0.8 indicates that Chemical Compound (C12H21NO8S) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Chemical Compound (C12H21NO8S). Following Lipinski's Rule of Five, Chemical Compound (C12H21NO8S) has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Chemical Compound (C12H21NO8S) is 1279037-95-4.
The molecular formula of Chemical Compound (C12H21NO8S) is C12H21NO8S.
The molecular weight of Chemical Compound (C12H21NO8S) is 339.0988 g/mol.
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