5'-O-Tritylthymidine - CAS 7791-71-1
Catalog: |
BB036075 |
Product Name: |
5'-O-Tritylthymidine |
CAS: |
7791-71-1 |
Synonyms: |
5'-O-Trityl-thymidine |
IUPAC Name: | 1-[(2R,4S,5R)-4-hydroxy-5-(trityloxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione |
Description: | 5'-O-Tritylthymidine (CAS# 7791-71-1) is a useful research chemical compound. |
Molecular Weight: | 484.54 |
Molecular Formula: | C29H28N2O5 |
Canonical SMILES: | CC1=CN(C(=O)NC1=O)C2CC(C(O2)COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O |
InChI: | InChI=1S/C29H28N2O5/c1-20-18-31(28(34)30-27(20)33)26-17-24(32)25(36-26)19-35-29(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,18,24-26,32H,17,19H2,1H3,(H,30,33,34)/t24-,25+,26+/m0/s1 |
InChI Key: | FZDHVUVGQXVYOP-JIMJEQGWSA-N |
Melting Point: | 125 °C |
Purity: | ≥ 95 % (HPLC) |
Density: | 1.275±0.06 g/cm3(Predicted) |
Appearance: | White to off-white powder |
Storage: | Store at -20 °C |
LogP: | 3.50210 |
Publication Number | Title | Priority Date |
US-10584363-B2 | Methods of producing and using single-stranded deoxyribonucleic acids and compositions for use in practicing the same | 20160603 |
US-2017349927-A1 | Methods of producing and using single-stranded deoxyribonucleic acids and compositions for use in practicing the same | 20160603 |
US-2020232005-A1 | Methods of Producing and Using Single-Stranded Deoxyribonucleic Acids and Compositions for Use in Practicing the Same | 20160603 |
WO-2017201043-A1 | Combination therapy for treating cancer | 20160516 |
JP-2018512862-A | Aggregation detection method and composition used in carrying out the method | 20150417 |
PMID | Publication Date | Title | Journal |
16675660 | 20060801 | 5'-O-tritylated nucleoside derivatives: inhibition of thymidine phosphorylase and angiogenesis | Molecular pharmacology |
12527796 | 20030201 | Non-nucleoside inhibitors of mitochondrial thymidine kinase (TK-2) differentially inhibit the closely related herpes simplex virus type 1 TK and Drosophila melanogaster multifunctional deoxynucleoside kinase | Molecular pharmacology |
12213066 | 20020912 | Acyclic nucleoside analogues as novel inhibitors of human mitochondrial thymidine kinase | Journal of medicinal chemistry |
Complexity: | 765 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 3 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 484.199822 |
Formal Charge: | 0 |
Heavy Atom Count: | 36 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 484.199822 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 88.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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