1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil
TL;DR: 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil (CAS 38359-55-6) is a chemical compound with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-oxooxolan-2-yl]methyl benzoate
Also Known As: 1-Bdgpu, 1-(5'-O-Benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil, [(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-oxooxolan-2-yl]methyl benzoate, 1-(5'-O-Benzoyl-3'-deoxy-beta-D-glycero-pentafuran-2'-ulosyl)uracil, 2,4(1H,3H)-Pyrimidinedione, 1-(5-((benzoyloxy)methyl)tetrahydro-3-oxo-2-furanyl)-, (2R-cis)-
| Molecular Formula | C16H14N2O6 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 0.2502 |
| Topological Polar Surface Area | 107.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.08517 |
| Heavy Atoms | 24 |
| Complexity | 869.88153 |
Chemical Identifiers
| CAS Number | 38359-55-6 |
|---|---|
| SMILES | C1[C@H](O[C@H](C1=O)N2C=CC(=O)NC2=O)COC(=O)C3=CC=CC=C3 |
Product Overview
1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil (CAS 38359-55-6), with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol. IUPAC: [(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-oxooxolan-2-yl]methyl benzoate.
Chemical Property Profile of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil
Property Insights of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil
The XLogP value of 0.2502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil. The TPSA of 107.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil. Following Lipinski's Rule of Five, 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil 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
Frequently Asked Questions
What is the CAS number of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil?
The CAS number of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil is 38359-55-6.
What is the molecular formula of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil?
The molecular formula of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil is C16H14N2O6.
What is the molecular weight of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil?
The molecular weight of 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil is 330.09 g/mol.
Where can I buy 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil?
You can request a quote for 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil?
Yes, KEHONG BIO provides custom synthesis services for 1-(5'-O-benzoyl-3'-deoxypentofuran-2'-ulosyl)uracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.