N-[2-(4-nitrophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-(piperidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-[2-(4-nitrophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-(piperidine-1-sulfonyl)benzamide
N-[2-(4-nitrophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-(piperidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | K410-0538 |
| Compound Name: | N-[2-(4-nitrophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-4-(piperidine-1-sulfonyl)benzamide |
| Molecular Weight: | 545.59 |
| Molecular Formula: | C23 H23 N5 O7 S2 |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)C(Nc1c2CS(Cc2nn1c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0201 |
| logD: | 2.0116 |
| logSw: | -2.6605 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 131.794 |
| InChI Key: | FKFHNMSRSGTQFG-UHFFFAOYSA-N |