3-{[(2,4-difluorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-{[(2,4-difluorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-{[(2,4-difluorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K018-0076 |
| Compound Name: | 3-{[(2,4-difluorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 345.37 |
| Molecular Formula: | C17 H13 F2 N3 O S |
| Smiles: | C1CCc2c(C1)c1C(N(C=Nc1s2)/N=C/c1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.803 |
| logD: | 3.802 |
| logSw: | -4.317 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.037 |
| InChI Key: | UVIGZZFJXMVOJO-UHFFFAOYSA-N |