N-[(1,5-dimethyl-1H-pyrazol-4-yl)carbamothioyl]-1,3-diphenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[(1,5-dimethyl-1H-pyrazol-4-yl)carbamothioyl]-1,3-diphenyl-1H-pyrazole-4-carboxamide
N-[(1,5-dimethyl-1H-pyrazol-4-yl)carbamothioyl]-1,3-diphenyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | Y503-4442 |
| Compound Name: | N-[(1,5-dimethyl-1H-pyrazol-4-yl)carbamothioyl]-1,3-diphenyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 416.5 |
| Molecular Formula: | C22 H20 N6 O S |
| Smiles: | Cc1c(cnn1C)NC(NC(c1cn(c2ccccc2)nc1c1ccccc1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.2257 |
| logD: | 3.2254 |
| logSw: | -3.6835 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.661 |
| InChI Key: | LVSLRVMFKFUFDM-UHFFFAOYSA-N |