N-[2-(2,4-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-[(propan-2-yl)oxy]benzamide
Chemical Structure Depiction of
N-[2-(2,4-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-[(propan-2-yl)oxy]benzamide
N-[2-(2,4-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-[(propan-2-yl)oxy]benzamide
Compound characteristics
Compound ID: | K410-0859 |
Compound Name: | N-[2-(2,4-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-[(propan-2-yl)oxy]benzamide |
Molecular Weight: | 439.53 |
Molecular Formula: | C23 H25 N3 O4 S |
Smiles: | CC(C)Oc1ccc(cc1)C(Nc1c2CS(Cc2nn1c1ccc(C)cc1C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9089 |
logD: | 3.9043 |
logSw: | -4.0611 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.203 |
InChI Key: | KCDKIVJFLOBLRG-UHFFFAOYSA-N |