1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one
TL;DR: 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one (CAS 15043-17-1) is a chemical compound with molecular formula C16H14N2O6 and molecular weight 330.08517 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2,4-dioxopyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl benzoate
Also Known As: NCIOpen2_009611, KST-1B0589, 1-(2,3-anhydro-5-o-benzoylpentofuranosyl)pyrimidine-2,4(1h,3h)-dione, 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one, [4-(2,4-dioxopyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methyl benzoate
Technical Specifications
| Molecular Formula | C16H14N2O6 |
| Molecular Weight | 330.08517 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 97.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.08517 Da |
| Heavy Atoms | 24 |
| Complexity | 585.0 |
| SMILES | C1=CC=C(C=C1)C(=O)OCC2C3C(O3)C(O2)N4C=CC(=O)NC4=O |
| InChIKey | WKMZPURUSZTWHP-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one
Property Insights of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one. The TPSA of 97.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one. Following Lipinski's Rule of Five, 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one?
The CAS number of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one is 15043-17-1.
What is the molecular formula of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one?
The molecular formula of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one is C16H14N2O6.
What is the molecular weight of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one?
The molecular weight of 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one is 330.08517 g/mol.
Where can I buy 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one?
You can request a quote for 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 1-(2,3-Anhydro-5-O-benzoylpentofuranosyl)-4-hydroxypyrimidin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.