TL;DR: 2'-Deoxy-5-propyl-4'-thiouridine (CAS 134700-09-7) is a chemical compound with molecular formula C12H18N2O4S and molecular weight 286.09872 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-5-propylpyrimidine-2,4-dione
Also Known As: 2'-Deoxy-5-propyl-4'-thiouridine, 5-Propyl-2'-deoxy-4'-thiouridine, uridine, 2'-deoxy-5-propyl-4'-thio-, J1.367.383G, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-5-propylpyrimidine-2,4-dione
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H18N2O4S |
| Molecular Weight | 286.09872 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.09872 Da |
| Heavy Atoms | 19 |
| Complexity | 413.0 |
| SMILES | CCCC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](S2)CO)O |
| InChIKey | FLKWXTHVVIQNHN-IVZWLZJFSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Deoxy-5-propyl-4'-thiouridine. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Deoxy-5-propyl-4'-thiouridine. Following Lipinski's Rule of Five, 2'-Deoxy-5-propyl-4'-thiouridine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2'-Deoxy-5-propyl-4'-thiouridine is 134700-09-7.
The molecular formula of 2'-Deoxy-5-propyl-4'-thiouridine is C12H18N2O4S.
The molecular weight of 2'-Deoxy-5-propyl-4'-thiouridine is 286.09872 g/mol.
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