3,4-diethoxy-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
Chemical Structure Depiction of
3,4-diethoxy-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
3,4-diethoxy-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
Compound characteristics
| Compound ID: | K410-0605 |
| Compound Name: | 3,4-diethoxy-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C22 H22 F N3 O5 S |
| Smiles: | CCOc1ccc(cc1OCC)C(Nc1c2CS(Cc2nn1c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1417 |
| logD: | 2.1413 |
| logSw: | -3.0096 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.122 |
| InChI Key: | GWBXHIBWIXZDAW-UHFFFAOYSA-N |