2-(3-methyl-4-nitro-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
Chemical Structure Depiction of
2-(3-methyl-4-nitro-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
2-(3-methyl-4-nitro-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | Y500-4130 |
| Compound Name: | 2-(3-methyl-4-nitro-1H-pyrazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide |
| Molecular Weight: | 374.38 |
| Molecular Formula: | C15 H14 N6 O4 S |
| Smiles: | CC(C(NN1C(=Nc2ccccc2C1=O)S)=O)n1cc(c(C)n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0742 |
| logD: | -5.7526 |
| logSw: | -2.0939 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.965 |
| InChI Key: | KKGACIOBDWAUOD-VIFPVBQESA-N |