2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine
TL;DR: 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine (CAS 128114-99-8) is a chemical compound with molecular formula C29H25FN2O4 and molecular weight 484.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9S,10R,12S)-12-fluoro-4-methyl-10-(trityloxymethyl)-8,11-dioxa-2,6-diazatricyclo[7.2.1.02,7]dodeca-3,6-dien-5-one
Also Known As: Trityl-lyxofuranosyl-T, fluoro-methyl-(trityloxymethyl)[?]one, 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine, 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-.beta.-D-lyxofuranosyl)thymine, (2S,3R,5R,11S)-11-Fluoro-8-methyl-3-[(triphenylmethoxy)methyl]-2,3-dihydro-5H,9H-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-9-one
| Molecular Formula | C29H25FN2O4 |
|---|---|
| Molecular Weight | 484.18 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 484.17984 |
| Heavy Atoms | 36 |
| Complexity | 827.0 |
Chemical Identifiers
| CAS Number | 128114-99-8 |
|---|---|
| SMILES | CC1=CN2[C@H]3[C@H]([C@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)OC2=NC1=O)F |
| InChIKey | DPSJICBTCIHLOT-DPRQWMOBSA-N |
Product Overview
2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine (CAS 128114-99-8), with molecular formula C29H25FN2O4 and molecular weight 484.18 g/mol. IUPAC: (1R,9S,10R,12S)-12-fluoro-4-methyl-10-(trityloxymethyl)-8,11-dioxa-2,6-diazatricyclo[7.2.1.02,7]dodeca-3,6-dien-5-one.
Chemical Property Profile of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine
Property Insights of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine
The XLogP value of 4.9 indicates that 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine. Following Lipinski's Rule of Five, 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine has 0 hydrogen bond donor(s) and 5 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 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine?
The CAS number of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine is 128114-99-8.
What is the molecular formula of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine?
The molecular formula of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine is C29H25FN2O4.
What is the molecular weight of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine?
The molecular weight of 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine is 484.18 g/mol.
Where can I buy 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine?
You can request a quote for 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine?
Yes, KEHONG BIO provides custom synthesis services for 2,3'-Anhydro-1-(2-deoxy-2-fluoro-5-O-trityl-beta-D-lyxofuranosyl)thymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.