2-methyl-N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]propanamide
Chemical Structure Depiction of
2-methyl-N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]propanamide
2-methyl-N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]propanamide
Compound characteristics
| Compound ID: | K410-0096 |
| Compound Name: | 2-methyl-N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]propanamide |
| Molecular Weight: | 333.41 |
| Molecular Formula: | C16 H19 N3 O3 S |
| Smiles: | CC(C)C(Nc1c2CS(Cc2nn1c1ccccc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.02 |
| logD: | 2.0194 |
| logSw: | -2.4055 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.672 |
| InChI Key: | LOCUQMJBPTVAKP-UHFFFAOYSA-N |