N-(3-cyanophenyl)-5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1H-pyrazole-3-carboxamide
N-(3-cyanophenyl)-5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0344 |
| Compound Name: | N-(3-cyanophenyl)-5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)c1cc(C(Nc2cccc(C#N)c2)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4872 |
| logD: | 3.487 |
| logSw: | -3.8015 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.479 |
| InChI Key: | FHGULOZGSZCVPM-HXUWFJFHSA-N |