2-(4,6-dimethylpyrimidin-2-yl)-5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(4,6-dimethylpyrimidin-2-yl)-5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
2-(4,6-dimethylpyrimidin-2-yl)-5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8137-0223 |
| Compound Name: | 2-(4,6-dimethylpyrimidin-2-yl)-5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C15 H16 N6 O S |
| Smiles: | Cc1ccnc(n1)SCC1CC(N(c2nc(C)cc(C)n2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5101 |
| logD: | 0.2121 |
| logSw: | -2.1539 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.041 |
| InChI Key: | ZISXQWBAHVGUIF-UHFFFAOYSA-N |