N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]acetamide
Chemical Structure Depiction of
N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]acetamide
N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]acetamide
Compound characteristics
| Compound ID: | K410-0092 |
| Compound Name: | N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]acetamide |
| Molecular Weight: | 305.35 |
| Molecular Formula: | C14 H15 N3 O3 S |
| Smiles: | CC(Nc1c2CS(Cc2nn1c1ccccc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9197 |
| logD: | 0.9195 |
| logSw: | -2.1048 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.571 |
| InChI Key: | CECGCDIGLSLLAN-UHFFFAOYSA-N |