3-(4-chlorophenyl)-4-(3,4-dimethylanilino)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-(3,4-dimethylanilino)cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-(3,4-dimethylanilino)cyclobut-3-ene-1,2-dione
Compound characteristics
Compound ID: | E786-0098 |
Compound Name: | 3-(4-chlorophenyl)-4-(3,4-dimethylanilino)cyclobut-3-ene-1,2-dione |
Molecular Weight: | 311.77 |
Molecular Formula: | C18 H14 Cl N O2 |
Smiles: | Cc1ccc(cc1C)NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.765 |
logD: | 4.7647 |
logSw: | -4.863 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 35.894 |
InChI Key: | FCKWCUVSGHWVCW-UHFFFAOYSA-N |