3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one
3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y500-3959 |
| Compound Name: | 3-(1,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one |
| Molecular Weight: | 272.33 |
| Molecular Formula: | C13 H12 N4 O S |
| Smiles: | Cc1c(cnn1C)N1C(=Nc2ccccc2C1=O)S |
| Stereo: | ACHIRAL |
| logP: | 0.6809 |
| logD: | -5.0902 |
| logSw: | -1.9092 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.123 |
| InChI Key: | DJYZTUJCJMROBY-UHFFFAOYSA-N |