N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]acetamide
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D306-0524 |
| Compound Name: | N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 369.44 |
| Molecular Formula: | C18 H19 N5 O2 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(CSc1cc(C)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8638 |
| logD: | 0.8237 |
| logSw: | -2.1143 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.475 |
| InChI Key: | WRCRAXVXDLDAKX-UHFFFAOYSA-N |