AC1LCLVU
ethyl 2-[[2-[1-(4-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylacetyl]amino]acetate
Also Known As: BAS 05100490|F1874-0669|ethyl 2-(2-((1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)acetamido)acetate|ethyl 2-(2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamido)acetate|ethyl 2-[[2-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetyl]amino]acetate|ethyl N-({[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetyl)glycinate|{2-[1-(4-Chloro-phenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl]-acetylamino}-acetic acid ethyl ester|ethyl ({[1-(p-chlorophenyl)-1,2,5,7-tetraaza-1H-inden-4-ylthio]methyl}carbonylamino)acetate
| Molecular Formula | C17H16ClN5O3S |
|---|---|
| Molecular Weight | 405.06622 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 405.06622 |
| Monoisotopic Mass | 405.06622 |
| Heavy Atoms | 27 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 577756-72-0 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CSC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)Cl |
| InChIKey | QTHBOVPTJUVISZ-UHFFFAOYSA-N |
Product Overview
AC1LCLVU (CAS 577756-72-0), with molecular formula C17H16ClN5O3S and molecular weight 405.06622 g/mol. IUPAC: ethyl 2-[[2-[1-(4-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylacetyl]amino]acetate.