TL;DR: 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose (CAS 124681-22-7) is a chemical compound with molecular formula C18H35NO7 and molecular weight 377.24136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]dodecanamide
Also Known As: 2-Hdadg, 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose, 2-Deoxy-2-[(1,3-dihydroxydodecylidene)amino]hexose, 2-Deoxy-2-[(1,3-dihydroxydodecylidene)amino]-D-glucose, D-Glucose, 2-deoxy-2-((3-hydroxy-1-oxododecyl)amino)-
| Molecular Formula | C18H35NO7 |
| Molecular Weight | 377.24136 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 377.24136 Da |
| Heavy Atoms | 26 |
| Complexity | 381.0 |
| SMILES | CCCCCCCCCC(CC(=O)N[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)O)O |
| InChIKey | ZSPOMVMMJMVHAN-AGJUIOJISA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose. The TPSA of 147.0 Ų indicates high polarity, suggesting 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose is 124681-22-7.
The molecular formula of 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose is C18H35NO7.
The molecular weight of 2-(3-Hydroxydodecanoylamino)-2-deoxyglucose is 377.24136 g/mol.
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