5-(4-fluoroanilino)-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(4-fluoroanilino)-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(4-fluoroanilino)-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0292 |
| Compound Name: | 5-(4-fluoroanilino)-3-[4-(pyrimidin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 492.51 |
| Molecular Formula: | C28 H21 F N6 O2 |
| Smiles: | C1CN(CCN1c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1ccc(cc1)F)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 6.5325 |
| logD: | 6.5325 |
| logSw: | -6.2338 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.17 |
| InChI Key: | MWWYDCTVOTUPKL-UHFFFAOYSA-N |