AC1LDB4O
ethyl 2-[[2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylacetyl]amino]acetate
Also Known As: BAS 05099518|[2-(1-Phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)-acetylamino]-acetic acid ethyl ester|ethyl 2-(2-((1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)acetamido)acetate|F1874-0066|ethyl 2-[[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]amino]acetate|ethyl 2-[2-({1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}sulfanyl)acetamido]acetate|[2-(1-Phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)-acetylamino]-acetic acid|ethyl N-{[(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetyl}glycinate
| Molecular Formula | C17H17N5O3S |
|---|---|
| Molecular Weight | 371.10522 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 371.10522 |
| Monoisotopic Mass | 371.10522 |
| Heavy Atoms | 26 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 516461-36-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CSC1=NC=NC2=C1C=NN2C3=CC=CC=C3 |
| InChIKey | UNQKDWAXBQZOKQ-UHFFFAOYSA-N |
Product Overview
AC1LDB4O (CAS 516461-36-2), with molecular formula C17H17N5O3S and molecular weight 371.10522 g/mol. IUPAC: ethyl 2-[[2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylacetyl]amino]acetate.
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