2-(4-fluoroanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(4-fluoroanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
2-(4-fluoroanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 7687-0005 |
| Compound Name: | 2-(4-fluoroanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C21 H20 F N3 O2 |
| Smiles: | CN1CCN(CC1)C1=C(C(c2ccccc2C1=O)=O)Nc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.9482 |
| logD: | 2.3905 |
| logSw: | -3.9504 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.411 |
| InChI Key: | RSQCYRSNPCLBAU-UHFFFAOYSA-N |