3-(4-ethylpiperazin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(4-ethylpiperazin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(4-ethylpiperazin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0303 |
| Compound Name: | 3-(4-ethylpiperazin-1-yl)-5-(3-fluoroanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C26 H23 F N4 O2 |
| Smiles: | CCN1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 6.0197 |
| logD: | 5.6003 |
| logSw: | -5.877 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.084 |
| InChI Key: | FOTXOWITEVHKEO-UHFFFAOYSA-N |