2-chloro-3-[4-(4-fluorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione
Chemical Structure Depiction of
2-chloro-3-[4-(4-fluorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione
2-chloro-3-[4-(4-fluorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 5075-0103 |
| Compound Name: | 2-chloro-3-[4-(4-fluorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione |
| Molecular Weight: | 398.82 |
| Molecular Formula: | C21 H16 Cl F N2 O3 |
| Smiles: | C1CN(CCN1C1=C(C(c2ccccc2C1=O)=O)[Cl])C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.453 |
| logD: | 3.453 |
| logSw: | -4.265 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.279 |
| InChI Key: | DOQDSIHGYWSLJM-UHFFFAOYSA-N |