TL;DR: Anhydrothymidine (CAS 15981-92-7) is a chemical compound with molecular formula C10H12N2O4 and molecular weight 224.07971 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-(hydroxymethyl)-4-methyl-8,11-dioxa-2,6-diazatricyclo[7.2.1.02,7]dodeca-3,6-dien-5-one
Also Known As: Anhydrothymidine, Cyclothymidine, 2,3'-ANHYDROTHYMIDINE, O2,3'-Cyclothymidine, 2,3'-O-Cyclothymidine
| Molecular Formula | C10H12N2O4 |
| Molecular Weight | 224.07971 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.07971 Da |
| Heavy Atoms | 16 |
| Complexity | 404.0 |
| SMILES | CC1=CN2C3CC(C(O3)CO)OC2=NC1=O |
| InChIKey | JCSNHEYOIASGKU-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that Anhydrothymidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Anhydrothymidine. Following Lipinski's Rule of Five, Anhydrothymidine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Anhydrothymidine is 15981-92-7.
The molecular formula of Anhydrothymidine is C10H12N2O4.
The molecular weight of Anhydrothymidine is 224.07971 g/mol.
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