3-(4-chlorophenyl)-4-{[(3-methoxyphenyl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-{[(3-methoxyphenyl)methyl]amino}cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-{[(3-methoxyphenyl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0121 |
| Compound Name: | 3-(4-chlorophenyl)-4-{[(3-methoxyphenyl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 327.77 |
| Molecular Formula: | C18 H14 Cl N O3 |
| Smiles: | COc1cccc(CNC2=C(C(C2=O)=O)c2ccc(cc2)[Cl])c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4387 |
| logD: | 3.4386 |
| logSw: | -3.904 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.76 |
| InChI Key: | JIHAOMOMIHXTTA-UHFFFAOYSA-N |