3-(3-bromoanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3-bromoanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
3-(3-bromoanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0182 |
| Compound Name: | 3-(3-bromoanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 362.61 |
| Molecular Formula: | C16 H9 Br Cl N O2 |
| Smiles: | c1cc(cc(c1)[Br])NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5856 |
| logD: | 4.5642 |
| logSw: | -4.7718 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.894 |
| InChI Key: | GYPNLXAZWCVNBX-UHFFFAOYSA-N |