3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | Y502-2706 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide |
| Molecular Weight: | 343.41 |
| Molecular Formula: | C16 H17 N5 O2 S |
| Smiles: | Cc1cc(C)n(CCC(NN2C(=Nc3ccccc3C2=O)S)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.0746 |
| logD: | -5.9013 |
| logSw: | -2.2255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.722 |
| InChI Key: | XWBDKLFHAZEGAJ-UHFFFAOYSA-N |