3-bromo-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
Chemical Structure Depiction of
3-bromo-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
3-bromo-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
Compound characteristics
| Compound ID: | K410-0569 |
| Compound Name: | 3-bromo-N-[2-(4-fluorophenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide |
| Molecular Weight: | 450.28 |
| Molecular Formula: | C18 H13 Br F N3 O3 S |
| Smiles: | C1c2c(CS1(=O)=O)nn(c1ccc(cc1)F)c2NC(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8751 |
| logD: | 2.8544 |
| logSw: | -3.4906 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.701 |
| InChI Key: | KKNZNYJDHDEERH-UHFFFAOYSA-N |