3-(3,5-dimethylpiperidin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(3,5-dimethylpiperidin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(3,5-dimethylpiperidin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0231 |
| Compound Name: | 3-(3,5-dimethylpiperidin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C27 H24 F N3 O2 |
| Smiles: | CC1CC(C)CN(C1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cccc(c1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.5094 |
| logD: | 7.5094 |
| logSw: | -6.0519 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.414 |
| InChI Key: | PPFABRIDMLBULI-UHFFFAOYSA-N |