TL;DR: 2,6-diNH2-2'F-ddP (CAS 123318-81-0) is a chemical compound with molecular formula C10H13FN6O2 and molecular weight 268.1084 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2S,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluorooxolan-2-yl]methanol
Also Known As: 2,6-diNH2-2'F-ddP, 9H-Purine-2,6-diamine, 9-(2,3-dideoxy-2-fluoro-b-D-threo-pentofuranosyl)-, 9-(2,3-dideoxy-2-fluoro-beta-threo-pentofuranosyl)-2,6-diaminopurine, [(2S,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluorooxolan-2-yl]methanol, 9-(2,3-dideoxy-2-fluoro-.beta.-threo-pentofuranosyl)-2,6-diaminopurine
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H13FN6O2 |
| Molecular Weight | 268.1084 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.1084 Da |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
| SMILES | C1[C@H](O[C@H]([C@H]1F)N2C=NC3=C(N=C(N=C32)N)N)CO |
| InChIKey | PHDRWZXWRBXBOC-DQSPEZDDSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-diNH2-2'F-ddP. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-diNH2-2'F-ddP. Following Lipinski's Rule of Five, 2,6-diNH2-2'F-ddP has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,6-diNH2-2'F-ddP is 123318-81-0.
The molecular formula of 2,6-diNH2-2'F-ddP is C10H13FN6O2.
The molecular weight of 2,6-diNH2-2'F-ddP is 268.1084 g/mol.
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