N-(3-cyanophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
N-(3-cyanophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D473-1876 |
| Compound Name: | N-(3-cyanophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 436.49 |
| Molecular Formula: | C22 H20 N4 O4 S |
| Smiles: | COc1ccc(cc1)c1cc(C(Nc2cccc(C#N)c2)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6073 |
| logD: | 2.6071 |
| logSw: | -3.2009 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.023 |
| InChI Key: | ZTXKXYVTCCXUSI-GOSISDBHSA-N |