1,3-dimethyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1,3-dimethyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-1H-pyrazole-5-carboxamide
1,3-dimethyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y502-2233 |
| Compound Name: | 1,3-dimethyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 315.35 |
| Molecular Formula: | C14 H13 N5 O2 S |
| Smiles: | Cc1cc(C(NN2C(=Nc3ccccc3C2=O)S)=O)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.3044 |
| logD: | -5.5027 |
| logSw: | -2.2633 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.272 |
| InChI Key: | NGWGBTGUDRUEQL-UHFFFAOYSA-N |