TL;DR: [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol (CAS 115150-59-9) is a chemical compound with molecular formula C10H12ClN5O2 and molecular weight 269.06796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,5S)-5-(6-amino-2-chloropurin-9-yl)oxolan-2-yl]methanol
Also Known As: 2-Chloro-2',3'-dideoxyadenosine, KST-1A0707, Adenosine,2-chloro-2',3'-dideoxy- (9CI), J1.185.456G, [(2r,5s)-5-(6-amino-2-chloro-9h-purin-9-yl)tetrahydrofuran-2-yl]methanol
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H12ClN5O2 |
| Molecular Weight | 269.06796 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.06796 Da |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
| SMILES | C1C[C@H](O[C@H]1CO)N2C=NC3=C(N=C(N=C32)Cl)N |
| InChIKey | FNLILOONPKMGST-RITPCOANSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol. Following Lipinski's Rule of Five, [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol has 2 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 [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol is 115150-59-9.
The molecular formula of [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol is C10H12ClN5O2.
The molecular weight of [(2R,5S)-5-(6-amino-2-chloro-purin-9-yl)tetrahydrofuran-2-yl]methanol is 269.06796 g/mol.
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