3-(4-chlorophenyl)-4-{[(4-fluorophenyl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-{[(4-fluorophenyl)methyl]amino}cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-{[(4-fluorophenyl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0123 |
| Compound Name: | 3-(4-chlorophenyl)-4-{[(4-fluorophenyl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 315.73 |
| Molecular Formula: | C17 H11 Cl F N O2 |
| Smiles: | C(c1ccc(cc1)F)NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3704 |
| logD: | 3.3702 |
| logSw: | -3.7906 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.216 |
| InChI Key: | ZPPRILKTSWQIIG-UHFFFAOYSA-N |