DiOAcPhthN-D-arab-ddU deriv.
TL;DR: DiOAcPhthN-D-arab-ddU deriv. (CAS 133488-20-7) is a chemical compound with molecular formula C22H20FN3O9 and molecular weight 489.11835 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R)-2-acetyloxy-2-[(2S,3R,5S)-3-(1,3-dioxoisoindol-2-yl)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]ethyl] acetate
Also Known As: DiOAcPhthN-D-arab-ddU deriv., 1-(5,6-Dimethyl-2-benzimidazolyl)-aethanol, 2,4(1H,3H)-Pyrimidinedione, 1-(5,6-di-O-acetyl-2,3-dideoxy-3-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-alpha-D-arabino-hexofuranosyl)-5-fluoro-, 1-(5,6-Di-O-acetyl-2,3-dideoxy-3-phthalimido-2,3-dideoxy-alpha-D-arabino-hexofuranosyl)-5-fluorouracil, [(2R)-2-acetyloxy-2-[(2S,3R,5S)-3-(1,3-dioxoisoindol-2-yl)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]ethyl] acetate
Technical Specifications
| Molecular Formula | C22H20FN3O9 |
| Molecular Weight | 489.11835 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 149.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.11835 Da |
| Heavy Atoms | 35 |
| Complexity | 975.0 |
| SMILES | CC(=O)OC[C@H]([C@@H]1[C@@H](C[C@H](O1)N2C=C(C(=O)NC2=O)F)N3C(=O)C4=CC=CC=C4C3=O)OC(=O)C |
| InChIKey | YRWPHXXGCYWJOL-BDXSIMOUSA-N |
Chemical Property Profile of DiOAcPhthN-D-arab-ddU deriv.
Property Insights of DiOAcPhthN-D-arab-ddU deriv.
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DiOAcPhthN-D-arab-ddU deriv.. The TPSA of 149.0 Ų indicates high polarity, suggesting DiOAcPhthN-D-arab-ddU deriv. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DiOAcPhthN-D-arab-ddU deriv. has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of DiOAcPhthN-D-arab-ddU deriv.?
The CAS number of DiOAcPhthN-D-arab-ddU deriv. is 133488-20-7.
What is the molecular formula of DiOAcPhthN-D-arab-ddU deriv.?
The molecular formula of DiOAcPhthN-D-arab-ddU deriv. is C22H20FN3O9.
What is the molecular weight of DiOAcPhthN-D-arab-ddU deriv.?
The molecular weight of DiOAcPhthN-D-arab-ddU deriv. is 489.11835 g/mol.
Where can I buy DiOAcPhthN-D-arab-ddU deriv.?
You can request a quote for DiOAcPhthN-D-arab-ddU deriv. directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for DiOAcPhthN-D-arab-ddU deriv.?
Yes, CoreyChem provides custom synthesis services for DiOAcPhthN-D-arab-ddU deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.