9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[[2-(trifluoromethyl)phenyl]methylamino]-1H-purin-2-one structure
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Common Name | 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[[2-(trifluoromethyl)phenyl]methylamino]-1H-purin-2-one | ||
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| CAS Number | 62190-55-0 | Molecular Weight | 441.36100 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C18H18F3N5O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[[2-(trifluoromethyl)phenyl]methylamino]-1H-purin-2-one |
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| Synonym | More Synonyms |
| Molecular Formula | C18H18F3N5O5 |
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| Molecular Weight | 441.36100 |
| Exact Mass | 441.12600 |
| PSA | 145.78000 |
| LogP | 0.84730 |
| InChIKey | NIBXXIMVYHJSOO-XNIJJKJLSA-N |
| SMILES | O=c1nc2c(ncn2C2OC(CO)C(O)C2O)c(NCc2ccccc2C(F)(F)F)[nH]1 |
| Adenosine,1,2-dihydro-2-oxo-N-[[2-(trifluoromethyl)phenyl]methyl] |