ethyl N-({[1-(4-chlorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetyl)glycinate
Chemical Structure Depiction of
ethyl N-({[1-(4-chlorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetyl)glycinate
ethyl N-({[1-(4-chlorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetyl)glycinate
Compound characteristics
| Compound ID: | G873-0135 |
| Compound Name: | ethyl N-({[1-(4-chlorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetyl)glycinate |
| Molecular Weight: | 421.86 |
| Molecular Formula: | C17 H16 Cl N5 O4 S |
| Smiles: | CCOC(CNC(CSC1NC(c2cnn(c3ccc(cc3)[Cl])c2N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2072 |
| logD: | 2.1442 |
| logSw: | -3.343 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.353 |
| InChI Key: | LDFLLSJPKJGREG-UHFFFAOYSA-N |