Nsc 105,826
(2R,4R,5R)-2-(hydroxymethyl)-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolane-3,4-diol
Also Known As: NSC 105,826|NSC-105,826|4-Methylthio-7-beta-D-ribofuranosylpyrrolo(2,3-d)pyrimidine|(2R,4R,5R)-2-(hydroxymethyl)-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolane-3,4-diol|4-(methylsulfanyl)-7-[(3xi)-|A-d-erythro-pentofuranosyl]-7h-pyrrolo[2,3-d]pyrimidine|(2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-y
| Molecular Formula | C12H15N3O4S |
|---|---|
| Molecular Weight | 297.07834 g/mol |
| LogP | -0.24 |
| Topological Polar Surface Area | 100.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.07834 |
| Heavy Atoms | 20 |
| Complexity | 619.8 |
Chemical Identifiers
| CAS Number | 16754-86-2 |
|---|---|
| SMILES | CSC1=NC=NC2=C1C=CN2[C@H]3[C@@H](C([C@H](O3)CO)O)O |
Product Overview
Nsc 105,826 (CAS 16754-86-2), with molecular formula C12H15N3O4S and molecular weight 297.07834 g/mol. IUPAC: (2R,4R,5R)-2-(hydroxymethyl)-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolane-3,4-diol.
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