TL;DR: 5'-o-Acetyl-2',3'-o-isopropylideneadenosine (CAS 15888-38-7) is a chemical compound with molecular formula C15H19N5O5 and molecular weight 349.1386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl acetate
Also Known As: 5'-o-acetyl-2',3'-o-isopropylideneadenosine, 5'-Acetyl-2',3'-isopropylideneadenosine, 5'-Acetyl-2',3'-isopropylidene Adenosine, 5'-Acetyl-2',3'-isopropylenadenosine, 5-Acetyl-2,3-isopropylideneadenosine
| Molecular Formula | C15H19N5O5 |
| Molecular Weight | 349.1386 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.1386 Da |
| Heavy Atoms | 25 |
| Complexity | 534.0 |
| SMILES | CC(=O)OC[C@@H]1[C@@H]2[C@H]([C@@H](O1)N3C=NC4=C(N=CN=C43)N)OC(O2)(C)C |
| InChIKey | AGPPMENETHBDES-IDTAVKCVSA-N |
The XLogP value of -0.3 indicates that 5'-o-Acetyl-2',3'-o-isopropylideneadenosine 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 5'-o-Acetyl-2',3'-o-isopropylideneadenosine. Following Lipinski's Rule of Five, 5'-o-Acetyl-2',3'-o-isopropylideneadenosine 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 5'-o-Acetyl-2',3'-o-isopropylideneadenosine is 15888-38-7.
The molecular formula of 5'-o-Acetyl-2',3'-o-isopropylideneadenosine is C15H19N5O5.
The molecular weight of 5'-o-Acetyl-2',3'-o-isopropylideneadenosine is 349.1386 g/mol.
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