3-(4-chlorophenyl)-4-[(pyridin-3-yl)amino]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-[(pyridin-3-yl)amino]cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-[(pyridin-3-yl)amino]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0021 |
| Compound Name: | 3-(4-chlorophenyl)-4-[(pyridin-3-yl)amino]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 284.7 |
| Molecular Formula: | C15 H9 Cl N2 O2 |
| Smiles: | c1cc(cnc1)NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.7011 |
| logD: | 2.7003 |
| logSw: | -3.6629 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.412 |
| InChI Key: | HVTYVTCLLHLGDD-UHFFFAOYSA-N |