5-fluoro-1-(2,3,5-tri-O-benzoylpentofuranosyl)pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-fluoro-1-(2,3,5-tri-O-benzoylpentofuranosyl)pyrimidine-2,4(1H,3H)-dione
5-fluoro-1-(2,3,5-tri-O-benzoylpentofuranosyl)pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 3966-0329 |
| Compound Name: | 5-fluoro-1-(2,3,5-tri-O-benzoylpentofuranosyl)pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 574.52 |
| Molecular Formula: | C30 H23 F N2 O9 |
| Smiles: | C(C1C(C(C(N2C=C(C(NC2=O)=O)F)O1)OC(c1ccccc1)=O)OC(c1ccccc1)=O)OC(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.414 |
| logD: | 4.3651 |
| logSw: | -4.4012 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.874 |
| InChI Key: | JJFICUPIRKNFIU-UHFFFAOYSA-N |