N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-3,5-dimethylbenzamide
N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-3,5-dimethylbenzamide
Compound characteristics
Compound ID: | K410-0689 |
Compound Name: | N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-3,5-dimethylbenzamide |
Molecular Weight: | 411.48 |
Molecular Formula: | C21 H21 N3 O4 S |
Smiles: | Cc1cc(C)cc(c1)C(Nc1c2CS(Cc2nn1c1ccc(cc1)OC)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8296 |
logD: | 2.7988 |
logSw: | -3.5446 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.245 |
InChI Key: | FGODCIHOMLLJHV-UHFFFAOYSA-N |