3-{[(4-fluorophenyl)methyl]amino}-4-phenylcyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[(4-fluorophenyl)methyl]amino}-4-phenylcyclobut-3-ene-1,2-dione
3-{[(4-fluorophenyl)methyl]amino}-4-phenylcyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0408 |
| Compound Name: | 3-{[(4-fluorophenyl)methyl]amino}-4-phenylcyclobut-3-ene-1,2-dione |
| Molecular Weight: | 281.28 |
| Molecular Formula: | C17 H12 F N O2 |
| Smiles: | C(c1ccc(cc1)F)NC1=C(C(C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6707 |
| logD: | 2.6704 |
| logSw: | -2.9031 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.216 |
| InChI Key: | DYOCEVUIPAVIOY-UHFFFAOYSA-N |