TL;DR: ChemDiv1_019225 (CAS 1093230-07-9) is a chemical compound with molecular formula C25H27NO12S and molecular weight 565.12537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3,4,5-triacetyloxy-6-[3-hydroxy-4-[2-(1,3-thiazol-4-yl)acetyl]phenoxy]oxan-2-yl]methyl acetate
Also Known As: F0900-1858, [3,4,5-TRIS(ACETYLOXY)-6-{3-HYDROXY-4-[2-(1,3-THIAZOL-4-YL)ACETYL]PHENOXY}OXAN-2-YL]METHYL ACETATE, (2R,3R,4S,5R,6S)-2-(acetoxymethyl)-6-(3-hydroxy-4-(2-(thiazol-4-yl)acetyl)phenoxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate, [3,4,5-triacetyloxy-6-[3-hydroxy-4-[2-(1,3-thiazol-4-yl)acetyl]phenoxy]oxan-2-yl]methyl acetate, (3,4,5-triacetoxy-6-{3-hydroxy-4-[2-(1,3-thiazol-4-yl)acetyl]phenoxy}tetrahydro-2H-pyran-2-yl)methyl acetate
| Molecular Formula | C25H27NO12S |
| Molecular Weight | 565.12537 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 202.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 14 |
| Exact Mass | 565.12537 Da |
| Heavy Atoms | 39 |
| Complexity | 915.0 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C(C=C2)C(=O)CC3=CSC=N3)O)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | WAEKSZJQJUDRCQ-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_019225. The TPSA of 202.0 Ų indicates high polarity, suggesting ChemDiv1_019225 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ChemDiv1_019225 has 1 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ChemDiv1_019225 is 1093230-07-9.
The molecular formula of ChemDiv1_019225 is C25H27NO12S.
The molecular weight of ChemDiv1_019225 is 565.12537 g/mol.
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