2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-N'-[(pentafluorophenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-N'-[(pentafluorophenyl)methylidene]acetohydrazide
2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-N'-[(pentafluorophenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | Y501-9207 |
| Compound Name: | 2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-N'-[(pentafluorophenyl)methylidene]acetohydrazide |
| Molecular Weight: | 456.39 |
| Molecular Formula: | C19 H13 F5 N4 O2 S |
| Smiles: | C1CCc2c(C1)c1C(N(CC(N/N=C/c3c(c(c(c(c3F)F)F)F)F)=O)C=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9021 |
| logD: | 3.4643 |
| logSw: | -4.1704 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.536 |
| InChI Key: | KEVFMHWNELUZEI-UHFFFAOYSA-N |