2-[(2-cyanophenyl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide
Chemical Structure Depiction of
2-[(2-cyanophenyl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide
2-[(2-cyanophenyl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide
Compound characteristics
| Compound ID: | 8015-0874 |
| Compound Name: | 2-[(2-cyanophenyl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C25 H20 N4 O2 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(c1ccccc1Sc1ccccc1C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2016 |
| logD: | 2.9937 |
| logSw: | -3.748 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.496 |
| InChI Key: | ISVJSXJOTYPHHJ-UHFFFAOYSA-N |