TL;DR: AF-399/41692664 (CAS 956351-02-3) is a chemical compound with molecular formula C16H23NO6 and molecular weight 325.15253 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S,3R,4R,5S,6R)-2-(2,5-dimethylphenoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Also Known As: AF-399/41692664, N-((2S,3R,4R,5S,6R)-2-(2,5-dimethylphenoxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)acetamide, N-[(2S,3R,4R,5S,6R)-2-(2,5-dimethylphenoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide, N-[2-(2,5-dimethylphenoxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]acetamide
| Molecular Formula | C16H23NO6 |
| Molecular Weight | 325.15253 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.15253 Da |
| Heavy Atoms | 23 |
| Complexity | 406.0 |
| SMILES | CC1=CC(=C(C=C1)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)NC(=O)C |
| InChIKey | BPBFLUFQHFBBTE-OXGONZEZSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/41692664. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41692664. Following Lipinski's Rule of Five, AF-399/41692664 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AF-399/41692664 is 956351-02-3.
The molecular formula of AF-399/41692664 is C16H23NO6.
The molecular weight of AF-399/41692664 is 325.15253 g/mol.
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