ethyl 5-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate
ethyl 5-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 8009-2793 |
| Compound Name: | ethyl 5-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C20 H21 N5 O3 S |
| Smiles: | CCOC(c1cnn(c2ccccc2)c1NC(CSc1nc(C)cc(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3576 |
| logD: | 3.3101 |
| logSw: | -3.4317 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.513 |
| InChI Key: | HISMIMIZONJXOD-UHFFFAOYSA-N |