3-(4-methoxyphenyl)-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}propanamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}propanamide
3-(4-methoxyphenyl)-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}propanamide
Compound characteristics
| Compound ID: | P431-0852 |
| Compound Name: | 3-(4-methoxyphenyl)-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}propanamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C21 H24 N6 O2 S |
| Smiles: | COc1ccc(CCC(Nc2cnn(c2)c2ncc(cn2)N2CCSCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0567 |
| logD: | 2.0566 |
| logSw: | -2.649 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.012 |
| InChI Key: | PBJYPMIPDLLVDY-UHFFFAOYSA-N |