3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one
3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y500-3958 |
| Compound Name: | 3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-sulfanylquinazolin-4(3H)-one |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C15 H16 N4 O S |
| Smiles: | CCn1c(C)c(c(C)n1)N1C(=Nc2ccccc2C1=O)S |
| Stereo: | ACHIRAL |
| logP: | 1.1408 |
| logD: | -5.6001 |
| logSw: | -2.2392 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.613 |
| InChI Key: | ACZRRBVXMNZKFA-UHFFFAOYSA-N |