ethyl 2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-ethyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-ethyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate
ethyl 2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-ethyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | G953-0156 |
| Compound Name: | ethyl 2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-ethyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C22 H25 N5 O4 |
| Smiles: | CCC1=CC(N(CC(Nc2ccccc2C(=O)OCC)=O)C(=N1)n1c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1731 |
| logD: | 2.1639 |
| logSw: | -3.0136 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.187 |
| InChI Key: | IXORHQBZROIQAF-UHFFFAOYSA-N |