2-[(4-fluorophenyl)methylidene]-4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methylidene]-4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one
2-[(4-fluorophenyl)methylidene]-4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C311-1085 |
| Compound Name: | 2-[(4-fluorophenyl)methylidene]-4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C26 H23 F N4 O3 |
| Smiles: | C1CN(CCN1C(CN1C(/C(=C\c2ccc(cc2)F)Oc2ccccc12)=O)=O)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.6808 |
| logD: | 3.6719 |
| logSw: | -4.1326 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.197 |
| InChI Key: | PONGNPPYDHAMDV-UHFFFAOYSA-N |