TL;DR: 3'-Hydroxymethyl Ara U (CAS 130351-54-1) is a chemical compound with molecular formula C10H14N2O6 and molecular weight 258.08517 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,3S,4S,5S)-3-hydroxy-4,5-bis(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Also Known As: 3'-Hydroxymethyl Ara U, 3'-Deoxy-3'-C-(hydroxymethyl)-beta-D-arabino-pentofuranosyl uracil, 1-(3-Deoxy-3-hydroxymethyl-beta-D-arabinofuranosyl)uracil, 2,4(1H,3H)-Pyrimidinedione, 1-(3-deoxy-3-(hydroxymethyl)-beta-D-arabinofuranosyl)-, 1-[3-Deoxy-3-(hydroxymethyl)pentofuranosyl]-4-hydroxypyrimidin-2(1H)-one
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H14N2O6 |
| Molecular Weight | 258.08517 g/mol |
| XLogP | -1.8 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.08517 Da |
| Heavy Atoms | 18 |
| Complexity | 385.0 |
| SMILES | C1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)CO)CO)O |
| InChIKey | CCLQDVIPKKSCHR-MTSNSDSCSA-N |
The XLogP value of -1.8 indicates that 3'-Hydroxymethyl Ara U is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Hydroxymethyl Ara U. Following Lipinski's Rule of Five, 3'-Hydroxymethyl Ara U has 4 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 3'-Hydroxymethyl Ara U is 130351-54-1.
The molecular formula of 3'-Hydroxymethyl Ara U is C10H14N2O6.
The molecular weight of 3'-Hydroxymethyl Ara U is 258.08517 g/mol.
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