ethyl 4,5-dimethyl-2-{2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-{2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-{2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6481-5204 |
| Compound Name: | ethyl 4,5-dimethyl-2-{2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 483.57 |
| Molecular Formula: | C22 H21 N5 O4 S2 |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(CSC1=Nc2c(cn[nH]2)C(N1c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1182 |
| logD: | 1.3373 |
| logSw: | -3.2444 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.124 |
| InChI Key: | RGOXJJOCXYEXJN-UHFFFAOYSA-N |