N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-(trifluoromethyl)benzamide
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]-2-(trifluoromethyl)benzamide
N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | K410-0133 |
| Compound Name: | N-[2-(2-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-(trifluoromethyl)benzamide |
| Molecular Weight: | 435.42 |
| Molecular Formula: | C20 H16 F3 N3 O3 S |
| Smiles: | Cc1ccccc1n1c(c2CS(Cc2n1)(=O)=O)NC(c1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9 |
| logD: | 1.4307 |
| logSw: | -3.7612 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.4 |
| InChI Key: | PVEFPIOOCKBVLM-UHFFFAOYSA-N |