1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-3-carboxamide
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D473-1886 |
| Compound Name: | 1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C22 H23 N3 O4 S2 |
| Smiles: | COc1ccc(cc1)c1cc(C(Nc2cccc(c2)SC)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2073 |
| logD: | 3.2073 |
| logSw: | -3.7243 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.967 |
| InChI Key: | VGMLPMMJVNDZSP-QGZVFWFLSA-N |