2-chloro-3-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione
Chemical Structure Depiction of
2-chloro-3-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione
2-chloro-3-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 6027-0112 |
| Compound Name: | 2-chloro-3-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione |
| Molecular Weight: | 434.87 |
| Molecular Formula: | C20 H16 Cl F N2 O4 S |
| Smiles: | C1CN(CCN1C1=C(C(c2ccccc2C1=O)=O)[Cl])S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7244 |
| logD: | 3.7244 |
| logSw: | -4.382 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.341 |
| InChI Key: | FBYGDVRXCCZLLL-UHFFFAOYSA-N |