3-(4-chlorophenyl)-4-{[(5-methylfuran-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-{[(5-methylfuran-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-{[(5-methylfuran-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0153 |
| Compound Name: | 3-(4-chlorophenyl)-4-{[(5-methylfuran-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 301.73 |
| Molecular Formula: | C16 H12 Cl N O3 |
| Smiles: | [H]N(Cc1ccc(C)o1)C1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3989 |
| logD: | 3.3987 |
| logSw: | -3.7554 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.479 |
| InChI Key: | AFCRJIQWDZXARG-UHFFFAOYSA-N |